data_2lhs_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 2lhs _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.8 m80 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.951 0.405 . . . . 25.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.89 177.27 33.86 Favored Glycine 0 CA--C 1.508 -0.352 1 N-CA-C 101.928 -4.469 . . . . 25.0 101.928 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -145.84 163.95 33.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 119.973 1.886 . . . . 25.0 109.689 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -100.74 122.01 52.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 106.497 -1.668 . . . . 25.0 106.497 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.23 -42.37 59.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.634 -1.166 . . . . 25.0 109.684 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.7 t -153.53 130.18 5.63 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 105.653 -1.98 . . . . 25.0 105.653 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -65.2 132.13 14.46 Favored 'Cis proline' 0 C--N 1.346 0.433 0 CA-C-N 118.783 0.601 . . . . 25.0 111.09 -0.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.37 111.14 3.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.074 -0.512 . . . . 25.0 111.887 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 t -72.21 157.52 37.58 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 109.06 -0.718 . . . . 25.0 109.06 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.44 -24.66 31.82 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.625 0.77 . . . . 25.0 111.757 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.07 -54.61 23.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.933 0.873 . . . . 25.0 109.52 176.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.23 -37.18 84.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.175 -0.921 . . . . 25.0 110.204 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -62.52 -33.29 74.59 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 122.313 -0.242 . . . . 25.0 110.963 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -39.39 93.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.011 0.434 . . . . 25.0 110.725 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -70.04 -35.49 74.33 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.183 0.516 . . . . 25.0 109.669 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.1 mt -74.58 2.61 9.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.162 -0.472 . . . . 25.0 111.561 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 58.19 23.39 10.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.413 1.485 . . . . 25.0 112.926 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.433 ' C ' HD21 ' A' ' 19' ' ' ASN . 90.0 mt -84.96 -21.82 29.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 173.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.433 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -124.02 158.75 31.4 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.243 -2.132 . . . . 25.0 105.243 176.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 p -136.94 176.59 8.57 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.431 -0.581 . . . . 25.0 109.431 -177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 70.51 4.93 5.16 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.579 1.696 . . . . 25.0 115.579 174.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -67.83 -32.54 73.15 Favored 'General case' 0 CA--C 1.496 -1.113 0 O-C-N 121.354 -0.841 . . . . 25.0 110.563 172.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.19 -63.58 1.34 Allowed Glycine 0 C--O 1.215 -1.063 0 O-C-N 123.923 0.765 . . . . 25.0 112.151 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.6 t -88.08 -52.59 5.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.366 1.079 . . . . 25.0 112.343 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -65.97 -15.29 18.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.57 -1.196 . . . . 25.0 112.849 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.401 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 14.6 pt20 -84.33 -3.03 58.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.916 -0.49 . . . . 25.0 111.464 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -117.21 -35.65 3.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.182 -0.607 . . . . 25.0 110.264 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -127.0 94.06 40.33 Favored Pre-proline 0 C--O 1.243 0.76 0 N-CA-C 111.83 0.308 . . . . 25.0 111.83 171.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -74.02 -20.64 19.13 Favored 'Trans proline' 0 C--N 1.346 0.396 0 N-CA-C 115.121 1.162 . . . . 25.0 115.121 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -83.74 9.34 12.04 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.851 -0.531 . . . . 25.0 112.123 -177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.8 m -66.65 -16.05 63.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.789 0.663 . . . . 25.0 112.789 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.6 m -63.97 125.35 20.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.759 1.022 . . . . 25.0 113.759 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -152.95 153.64 33.39 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 105.891 -1.892 . . . . 25.0 105.891 178.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.4 -167.66 16.69 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 108.891 -1.684 . . . . 25.0 108.891 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.0 tp -123.92 142.04 51.5 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.261 1.03 . . . . 25.0 111.506 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.07 157.0 29.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.822 -1.177 . . . . 25.0 107.822 172.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 132.19 6.98 2.97 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 114.804 -1.089 . . . . 25.0 113.507 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -75.77 139.65 70.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 O-C-N 121.564 -0.963 . . . . 25.0 108.889 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -91.87 -15.56 18.95 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 N-CA-C 115.826 1.433 . . . . 25.0 115.826 -5.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -69.18 -36.71 77.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.15 1.537 . . . . 25.0 115.15 -169.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.14 30.28 7.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.641 -1.985 . . . . 25.0 105.641 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.36 -178.0 42.95 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.397 -1.274 . . . . 25.0 110.824 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -62.1 171.75 4.76 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 122.957 2.438 . . . . 25.0 113.391 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.92 160.02 31.12 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.8 -1.556 . . . . 25.0 106.8 173.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.73 138.7 58.07 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 107.694 -1.224 . . . . 25.0 107.694 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.68 -4.71 81.36 Favored Glycine 0 CA--C 1.51 -0.258 0 C-N-CA 121.267 -0.492 . . . . 25.0 113.045 -174.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -124.01 10.02 8.78 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.74 -0.837 . . . . 25.0 108.74 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.68 -49.77 75.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.716 -0.22 . . . . 25.0 111.516 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.07 -21.47 56.71 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.813 -0.554 . . . . 25.0 109.732 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.6 p -82.75 -8.01 59.62 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.565 0.58 . . . . 25.0 112.565 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.19 33.49 12.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.594 0.757 . . . . 25.0 110.547 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.16 39.12 26.3 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.838 1.422 . . . . 25.0 114.838 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -121.38 135.46 55.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.025 -0.534 . . . . 25.0 110.654 175.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -62.24 -34.4 76.45 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 115.05 1.5 . . . . 25.0 115.05 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -11.48 60.97 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.341 0.591 . . . . 25.0 112.275 -178.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.403 ' HA ' HD12 ' A' ' 59' ' ' LEU . 14.2 m-85 -115.42 13.12 16.45 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 107.474 -1.306 . . . . 25.0 107.474 -178.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -70.74 -37.11 73.43 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.015 -1.053 . . . . 25.0 110.7 -175.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.9 mp0 -69.42 -15.3 63.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.746 0.784 . . . . 25.0 110.421 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.94 -7.67 57.96 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -113.2 -33.54 5.95 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.423 0.527 . . . . 25.0 112.423 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -94.31 121.68 36.08 Favored 'General case' 0 CA--C 1.505 -0.774 0 O-C-N 121.602 -0.686 . . . . 25.0 109.697 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.427 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -129.41 161.0 31.37 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.57 -0.741 . . . . 25.0 109.024 177.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.6 p -118.42 161.46 35.23 Favored Pre-proline 0 C--N 1.319 -0.748 1 N-CA-C 99.978 -4.082 . . . . 25.0 99.978 162.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -69.95 0.04 6.36 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 116.993 -1.538 . . . . 25.0 115.923 -174.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.2 t -127.29 9.25 6.66 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.336 0.495 . . . . 25.0 112.336 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -82.26 -31.15 30.29 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.094 1.146 . . . . 25.0 114.094 -175.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.427 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 15.0 m95 -119.61 164.95 15.09 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 110.41 -0.218 . . . . 25.0 110.41 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -67.54 120.09 13.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.908 -1.886 . . . . 25.0 105.908 171.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -94.7 103.09 15.0 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 100.849 -3.76 . . . . 25.0 100.849 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.18 135.09 55.04 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.935 -1.03 . . . . 25.0 110.397 -177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -89.59 100.88 13.59 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.515 -1.22 . . . . 25.0 107.921 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.4 mt -130.26 173.85 10.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 -176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.64 157.08 23.58 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.584 -0.734 . . . . 25.0 111.008 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 58.6 p -77.12 167.12 22.31 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 106.703 -1.591 . . . . 25.0 106.703 172.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.14 -160.62 24.03 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 110.487 -1.045 . . . . 25.0 110.487 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.06 132.57 48.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 119.122 1.461 . . . . 25.0 114.43 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -138.58 161.68 36.47 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.13 -1.804 . . . . 25.0 106.13 177.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.8 p -103.38 149.85 24.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -137.14 100.97 4.41 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 105.521 -2.029 . . . . 25.0 105.521 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.31 114.72 28.8 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.105 0.955 . . . . 25.0 110.065 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -98.88 146.68 25.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.148 -0.933 . . . . 25.0 109.593 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -125.29 110.43 14.0 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 104.605 -2.368 . . . . 25.0 104.605 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -107.36 135.73 48.36 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.74 -0.664 . . . . 25.0 111.007 -172.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.6 t -98.93 16.15 23.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.856 0.836 . . . . 25.0 109.183 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -131.23 135.0 47.0 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.415 -0.587 . . . . 25.0 109.415 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -87.72 -11.98 46.63 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.391 0.515 . . . . 25.0 112.391 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.54 160.72 32.2 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.665 0.617 . . . . 25.0 112.665 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 155.96 39.75 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 116.101 1.889 . . . . 25.0 116.101 -171.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.7 t -102.55 159.24 15.62 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.973 -1.121 . . . . 25.0 107.973 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.3 t -117.9 -14.73 10.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.069 0.396 . . . . 25.0 112.069 172.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.3 t -171.23 153.61 3.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.022 0.439 . . . . 25.0 112.179 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -127.9 139.14 52.78 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 169.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -146.72 152.73 39.29 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.361 -0.977 . . . . 25.0 108.361 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -137.98 135.76 36.3 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.41 -1.7 . . . . 25.0 106.41 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.28 163.36 37.9 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.93 165.77 31.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 113.694 0.998 . . . . 25.0 113.694 -167.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.4 p -79.69 162.52 25.16 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 169.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -62.78 159.14 47.03 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.474 -0.784 . . . . 25.0 108.963 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.13 -25.54 31.42 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 116.194 -2.071 . . . . 25.0 113.985 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -113.93 32.03 6.14 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 122.811 0.444 . . . . 25.0 110.736 -175.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.2 p-90 -71.7 166.62 21.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.958 0.885 . . . . 25.0 112.818 -176.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.87 101.0 10.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.658 -1.155 . . . . 25.0 109.504 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -91.59 12.95 19.29 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 116.706 2.113 . . . . 25.0 116.706 -168.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.1 t -125.51 12.44 8.07 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.252 -1.018 . . . . 25.0 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.9 mp0 -114.09 157.12 43.02 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.374 -1.285 . . . . 25.0 107.886 -174.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.36 153.16 79.07 Favored 'Trans proline' 0 CA--C 1.533 0.451 0 O-C-N 121.953 0.449 . . . . 25.0 111.59 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 102.56 2.89 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.383 0.611 . . . . 25.0 111.932 -176.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.1 p -89.13 156.54 18.75 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.154 -1.054 . . . . 25.0 108.154 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -65.56 -25.89 67.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.265 0.555 . . . . 25.0 110.85 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.44 60.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.816 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.5 t -78.76 -7.68 58.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.37 0.507 . . . . 25.0 112.37 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.63 158.05 16.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.469 1.285 . . . . 25.0 114.469 -175.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -95.72 95.42 8.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 102.655 -3.091 . . . . 25.0 102.655 162.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.1 mt -66.15 -7.58 18.82 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.832 1.419 . . . . 25.0 114.832 -169.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.66 120.25 76.16 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 176.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.52 142.19 43.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.368 -2.621 . . . . 25.0 111.666 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -92.27 -12.31 32.92 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.249 0.462 . . . . 25.0 112.249 -175.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 69.3 m -148.05 64.71 1.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.367 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -88.93 130.97 35.34 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 118.496 -1.282 . . . . 25.0 109.062 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -119.79 99.08 6.42 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 103.689 -2.708 . . . . 25.0 103.689 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -94.02 91.83 7.05 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.6 118.84 37.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 104.424 -2.436 . . . . 25.0 104.424 173.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.35 81.8 0.41 Allowed Glycine 0 CA--C 1.502 -0.758 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.423 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.79 14.81 4.59 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.973 -0.632 . . . . 25.0 113.168 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.86 106.16 5.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.591 0.71 . . . . 25.0 109.691 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.6 123.94 90.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 105.353 -2.092 . . . . 25.0 105.353 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.79 168.87 23.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 N-CA-C 113.765 0.641 . . . . 25.0 113.765 -174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.459 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.82 26.77 4.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.51 -17.05 0.29 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 125.823 1.649 . . . . 25.0 112.188 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.9 mt-30 -128.21 153.13 47.26 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.034 -2.58 . . . . 25.0 104.034 169.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.8 t -142.82 95.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.2 t -94.01 126.64 39.35 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.74 166.99 21.68 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.416 -2.068 . . . . 25.0 105.416 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -130.71 154.39 48.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.581 -2.007 . . . . 25.0 105.581 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.63 160.19 36.24 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.628 -1.249 . . . . 25.0 107.628 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -104.38 116.43 32.12 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.192 0.307 . . . . 25.0 111.346 -176.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.4 mt -77.29 132.4 70.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.121 -1.066 . . . . 25.0 108.121 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -61.14 146.43 97.59 Favored 'Trans proline' 0 C--N 1.354 0.846 0 CA-C-O 121.655 0.606 . . . . 25.0 113.547 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.85 -26.11 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.197 -0.91 . . . . 25.0 112.802 -168.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.9 p-10 -84.16 9.69 12.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.545 0.688 . . . . 25.0 110.153 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.2 53.39 0.83 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.76 0.791 . . . . 25.0 108.977 172.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -86.04 169.32 13.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.409 -1.33 . . . . 25.0 107.409 175.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.75 -167.72 37.04 Favored Glycine 0 N--CA 1.451 -0.338 0 N-CA-C 115.733 1.053 . . . . 25.0 115.733 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -85.95 107.81 17.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.534 0.683 . . . . 25.0 110.478 -169.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 45.7 p-80 -157.21 171.92 19.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.678 -0.692 . . . . 25.0 110.512 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.9 p -108.03 150.64 10.54 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.125 -1.065 . . . . 25.0 108.125 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.8 mt -132.04 122.7 49.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 104.247 -2.501 . . . . 25.0 104.247 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.6 mp -105.05 127.68 52.99 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.588 -0.733 . . . . 25.0 110.004 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.16 127.59 55.98 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.851 -0.796 . . . . 25.0 108.851 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.63 140.62 46.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 122.075 0.94 . . . . 25.0 112.016 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -117.77 119.4 34.79 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.09 124.18 42.49 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.673 -0.862 . . . . 25.0 108.673 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.9 mm -76.75 141.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.084 -0.71 . . . . 25.0 109.084 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.69 -44.96 22.41 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.192 0.905 . . . . 25.0 110.482 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.14 -21.35 64.93 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -171.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 56.1 p -138.45 169.53 17.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.85 0.833 . . . . 25.0 109.765 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.66 23.2 0.54 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.284 -0.871 . . . . 25.0 112.107 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -94.94 144.12 25.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.36 143.77 16.64 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 104.513 -2.402 . . . . 25.0 104.513 172.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -145.87 134.87 22.62 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.739 0.644 . . . . 25.0 112.739 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.76 113.94 26.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.492 -0.776 . . . . 25.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.02 108.0 20.64 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.04 141.9 31.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.461 -0.79 . . . . 25.0 111.511 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.0 tt -125.37 133.84 68.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.478 -2.045 . . . . 25.0 105.478 167.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -93.7 131.26 39.2 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.1 m -132.59 161.07 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -175.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -117.64 95.02 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 103.67 -2.715 . . . . 25.0 103.67 167.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.57 163.82 14.44 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.027 -0.533 . . . . 25.0 112.29 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.7 p -145.68 163.37 35.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.015 -1.106 . . . . 25.0 108.015 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.403 ' C ' ' HZ2' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 CA-C-O 118.085 -0.96 . . . . 25.0 110.821 -178.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 m80 . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 110.294 -0.262 . . . . 25.0 110.294 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 142.78 169.74 12.47 Favored Glycine 0 C--O 1.229 -0.199 0 N-CA-C 103.283 -3.927 . . . . 25.0 103.283 -173.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -146.14 167.87 22.38 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.886 1.843 . . . . 25.0 109.793 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.92 125.11 64.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 107.103 -1.443 . . . . 25.0 107.103 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.93 -42.6 48.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.945 -1.025 . . . . 25.0 109.951 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.3 t -153.59 129.49 5.28 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 105.755 -1.943 . . . . 25.0 105.755 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -64.24 131.95 12.68 Favored 'Cis proline' 0 CA--C 1.533 0.432 0 C-N-CA 128.774 0.739 . . . . 25.0 111.373 -0.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.54 109.96 3.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.016 -0.538 . . . . 25.0 111.477 -173.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -72.0 162.42 29.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.559 -0.534 . . . . 25.0 109.559 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -60.0 -22.28 62.38 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.089 0.471 . . . . 25.0 111.765 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.53 19.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.809 -0.812 . . . . 25.0 108.809 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -64.93 -37.76 88.71 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.659 -0.7 . . . . 25.0 110.411 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -63.06 -32.14 73.44 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.311 -0.243 . . . . 25.0 111.058 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -39.62 92.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.051 0.453 . . . . 25.0 110.325 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -69.84 -34.22 73.35 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.168 0.509 . . . . 25.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -75.16 2.88 9.75 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.374 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.71 10.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.405 1.482 . . . . 25.0 112.778 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.454 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.6 mt -86.85 -21.71 26.23 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.335 -1.357 . . . . 25.0 107.335 173.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.454 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 157.35 32.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.337 -2.097 . . . . 25.0 105.337 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.2 p -135.6 176.21 8.88 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.987 -0.375 . . . . 25.0 109.987 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 72.15 5.29 5.27 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.096 1.517 . . . . 25.0 115.096 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -69.13 -39.7 78.71 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 121.734 -0.604 . . . . 25.0 110.908 173.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.99 -63.76 2.0 Favored Glycine 0 C--O 1.217 -0.908 0 N-CA-C 111.831 -0.508 . . . . 25.0 111.831 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.3 p -87.98 -52.98 4.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.466 1.127 . . . . 25.0 111.953 -178.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -68.2 -11.61 14.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.324 -1.307 . . . . 25.0 112.708 -171.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.22 -0.76 57.21 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.918 -0.489 . . . . 25.0 111.896 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -117.12 -35.44 4.07 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.679 -0.809 . . . . 25.0 109.845 172.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -127.04 94.8 38.38 Favored Pre-proline 0 CA--C 1.543 0.68 0 N-CA-C 111.797 0.295 . . . . 25.0 111.797 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -71.83 -19.92 26.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 N-CA-C 115.111 1.158 . . . . 25.0 115.111 -177.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.54 9.3 13.92 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 121.804 -0.56 . . . . 25.0 112.219 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.8 m -67.61 -14.67 63.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.7 m -64.11 131.9 29.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.238 0.829 . . . . 25.0 113.238 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -152.94 149.21 27.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.266 -1.012 . . . . 25.0 108.266 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.71 -168.3 17.83 Favored Glycine 0 N--CA 1.452 -0.233 0 N-CA-C 109.503 -1.439 . . . . 25.0 109.503 -178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.92 149.78 49.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.732 0.766 . . . . 25.0 111.213 -177.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.53 156.89 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.217 -1.401 . . . . 25.0 107.217 171.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.52 -0.14 3.4 Favored Glycine 0 C--N 1.318 -0.462 0 CA-C-N 115.099 -0.955 . . . . 25.0 113.373 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -75.93 146.44 79.24 Favored Pre-proline 0 C--N 1.321 -0.653 0 O-C-N 121.678 -0.895 . . . . 25.0 108.669 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.56 -16.97 16.52 Favored 'Cis proline' 0 CA--C 1.542 0.907 0 N-CA-C 115.834 1.436 . . . . 25.0 115.834 -5.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -74.09 -36.91 64.29 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.343 1.238 . . . . 25.0 114.343 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -111.63 32.86 5.11 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.322 -2.103 . . . . 25.0 105.322 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.29 -177.38 47.31 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.375 -1.284 . . . . 25.0 110.67 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -62.85 172.75 4.41 Favored 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 122.812 2.342 . . . . 25.0 113.784 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.08 30.96 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 106.44 -1.689 . . . . 25.0 106.44 173.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 139.47 58.05 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.489 -1.232 . . . . 25.0 108.072 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.89 -2.82 87.05 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 121.487 -0.387 . . . . 25.0 112.614 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.421 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 47.2 m170 -125.82 9.79 7.63 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.277 -0.543 . . . . 25.0 110.348 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.0 mt -66.29 -45.27 90.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 O-C-N 122.028 -0.42 . . . . 25.0 111.04 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.12 -23.43 57.89 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.863 -0.523 . . . . 25.0 109.882 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.0 p -82.83 -7.53 59.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.57 35.19 17.33 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.568 0.747 . . . . 25.0 110.499 -173.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.421 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 60.63 36.04 19.75 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -177.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -118.71 131.25 56.14 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 122.067 -0.395 . . . . 25.0 110.65 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -61.61 -32.28 72.4 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 113.922 1.082 . . . . 25.0 113.922 -176.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -9.98 55.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.821 0.674 . . . . 25.0 112.821 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 11.4 m-85 -121.7 16.37 11.09 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.79 -36.19 67.55 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.172 -0.955 . . . . 25.0 110.605 -177.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 mp0 -70.76 -16.63 62.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.088 0.947 . . . . 25.0 108.906 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.6 mp -88.85 -2.36 58.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.095 -0.957 . . . . 25.0 108.902 -178.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -112.1 -31.98 6.71 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -96.07 118.17 32.13 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.731 -0.606 . . . . 25.0 110.55 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.46 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.78 161.05 26.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.64 -0.709 . . . . 25.0 109.598 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 4.1 p -117.2 162.34 28.45 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 100.572 -3.862 . . . . 25.0 100.572 163.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.28 -4.96 14.75 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 116.756 -1.696 . . . . 25.0 115.972 -174.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -127.88 13.63 6.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.81 0.814 . . . . 25.0 111.022 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -77.81 -29.14 50.58 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.37 -0.831 . . . . 25.0 112.55 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.46 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.0 m95 -127.54 168.16 15.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 110.068 -0.345 . . . . 25.0 110.068 -178.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -67.94 120.94 15.03 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 106.6 -1.63 . . . . 25.0 106.6 171.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -95.8 104.76 16.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 100.358 -3.942 . . . . 25.0 100.358 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.83 134.95 53.14 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 114.857 -1.065 . . . . 25.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.05 99.86 12.79 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.56 -1.2 . . . . 25.0 107.925 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.3 mt -131.89 173.92 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 105.759 -1.941 . . . . 25.0 105.759 -176.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -116.51 168.95 9.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.576 0.703 . . . . 25.0 112.57 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.4 p -77.15 173.07 12.26 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 106.365 -1.717 . . . . 25.0 106.365 173.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.07 -162.23 33.64 Favored Glycine 0 C--O 1.241 0.546 0 C-N-CA 120.388 -0.911 . . . . 25.0 111.027 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.97 131.28 40.81 Favored 'Trans proline' 0 C--N 1.345 0.366 0 CA-C-N 118.869 1.334 . . . . 25.0 114.766 -175.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -138.17 161.39 36.95 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.8 p -104.85 152.03 23.11 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -139.31 101.01 4.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.969 -1.863 . . . . 25.0 105.969 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.91 110.16 22.2 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 122.063 0.935 . . . . 25.0 110.54 -178.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -93.96 147.69 22.87 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.28 -0.873 . . . . 25.0 110.113 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -125.34 110.13 13.62 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.741 -2.318 . . . . 25.0 104.741 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.0 mp -102.93 128.74 49.6 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.481 -0.782 . . . . 25.0 110.865 -171.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.8 t -85.58 3.9 38.59 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.105 0.479 . . . . 25.0 111.764 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.8 143.24 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.596 -0.52 . . . . 25.0 109.596 -177.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -84.13 -2.42 56.76 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.983 0.735 . . . . 25.0 112.983 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.97 158.76 24.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.075 0.769 . . . . 25.0 113.075 -176.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.7 t -75.78 155.97 34.98 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.367 1.247 . . . . 25.0 114.367 -172.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.5 t -103.37 155.98 18.08 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.6 -0.727 . . . . 25.0 109.615 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.4 t -117.79 -16.96 9.94 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 111.741 0.275 . . . . 25.0 111.741 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -171.34 154.31 3.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.069 0.461 . . . . 25.0 112.006 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -127.75 142.14 51.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 104.129 -2.545 . . . . 25.0 104.129 168.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -147.42 154.66 41.12 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.121 0.873 . . . . 25.0 108.93 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -137.91 139.01 39.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.888 -1.523 . . . . 25.0 106.888 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -148.9 164.33 34.82 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.573 0.624 . . . . 25.0 110.167 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.11 166.45 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -167.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 p -81.23 164.25 22.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.76 157.06 51.66 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.22 -0.9 . . . . 25.0 109.716 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -68.83 -20.07 39.94 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.891 -0.94 . . . . 25.0 114.535 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -120.96 32.02 6.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.228 0.455 . . . . 25.0 112.228 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.3 p-90 -74.95 164.86 26.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.694 0.759 . . . . 25.0 111.71 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -86.64 100.99 12.84 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.979 -1.01 . . . . 25.0 110.28 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -81.24 23.28 0.6 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 116.12 1.896 . . . . 25.0 116.12 -172.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 8.6 t -125.84 2.86 7.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.318 0.58 . . . . 25.0 110.482 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -108.69 157.02 37.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.329 -0.85 . . . . 25.0 109.477 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.4 153.21 78.13 Favored 'Trans proline' 0 C--N 1.348 0.539 0 O-C-N 121.943 0.444 . . . . 25.0 111.587 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 104.83 3.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.441 0.638 . . . . 25.0 112.313 -175.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.8 p -95.25 156.8 16.17 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 176.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -67.4 -25.17 65.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.3 0.571 . . . . 25.0 110.635 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.17 -25.13 63.29 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.277 -0.874 . . . . 25.0 111.858 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.4 t -85.05 -5.11 59.36 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.954 0.407 . . . . 25.0 111.807 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -103.11 153.83 19.91 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 114.993 1.479 . . . . 25.0 114.993 -174.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.35 90.02 4.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 102.604 -3.11 . . . . 25.0 102.604 163.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.0 -6.39 12.61 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.934 1.457 . . . . 25.0 114.934 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.2 t -80.13 132.68 59.17 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.165 -0.68 . . . . 25.0 109.165 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.8 149.8 48.72 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 114.94 -2.907 . . . . 25.0 110.82 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -102.63 -9.84 19.76 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.969 0.414 . . . . 25.0 111.425 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 54.5 m -150.36 67.89 0.97 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.451 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -89.02 132.88 34.55 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 118.87 -1.132 . . . . 25.0 108.788 175.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -121.68 99.06 6.25 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 104.166 -2.531 . . . . 25.0 104.166 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -89.65 92.11 8.94 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.134 -1.062 . . . . 25.0 108.134 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -109.17 118.28 36.33 Favored 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 107.428 -1.323 . . . . 25.0 107.428 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.69 80.87 0.42 Allowed Glycine 0 CA--C 1.501 -0.795 0 CA-C-N 115.568 -0.742 . . . . 25.0 112.963 -170.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.6 16.94 6.74 Favored Glycine 0 C--N 1.321 -0.289 0 C-N-CA 120.793 -0.717 . . . . 25.0 114.296 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.15 104.88 3.2 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.2 mt -68.68 122.33 84.37 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.27 170.54 19.34 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 117.748 -1.035 . . . . 25.0 113.694 -175.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.84 29.09 6.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.356 -0.979 . . . . 25.0 108.356 176.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.16 -15.67 0.33 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.693 1.597 . . . . 25.0 112.152 -174.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.461 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.1 mt-30 -128.59 152.47 48.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 103.598 -2.742 . . . . 25.0 103.598 170.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.3 t -141.38 95.11 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 107.013 -1.477 . . . . 25.0 107.013 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -84.92 134.72 34.25 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 105.514 -2.032 . . . . 25.0 105.514 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.47 165.77 26.35 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 105.626 -1.99 . . . . 25.0 105.626 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -135.5 152.22 51.12 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 104.705 -2.331 . . . . 25.0 104.705 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.87 160.24 30.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.38 -1.341 . . . . 25.0 107.38 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -103.44 118.87 37.74 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.111 0.257 . . . . 25.0 110.924 -177.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.0 mt -76.87 132.57 71.11 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.06 146.25 96.25 Favored 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-O 121.818 0.674 . . . . 25.0 113.456 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.75 -25.18 44.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.991 -1.004 . . . . 25.0 112.721 -169.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -84.48 7.98 18.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.682 -0.69 . . . . 25.0 110.119 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.6 mmt-85 -115.64 55.12 0.79 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 108.41 -0.959 . . . . 25.0 108.41 172.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.6 p -86.02 170.99 11.76 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.176 -1.787 . . . . 25.0 106.176 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.09 -169.53 44.15 Favored Glycine 0 C--N 1.32 -0.311 0 N-CA-C 115.64 1.016 . . . . 25.0 115.64 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.9 t -86.06 113.6 22.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.314 0.578 . . . . 25.0 110.86 -169.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.43 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 52.4 p-80 -159.92 171.78 18.79 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.956 -0.566 . . . . 25.0 111.049 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.6 p -105.01 151.16 7.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.348 -1.353 . . . . 25.0 107.348 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -134.63 128.33 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 102.475 -3.157 . . . . 25.0 102.475 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.8 mp -113.12 131.74 55.72 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 116.067 -0.515 . . . . 25.0 109.659 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.73 131.22 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 25.0 109.565 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -127.55 142.91 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 122.064 0.935 . . . . 25.0 112.525 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -115.57 119.66 36.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.84 -1.527 . . . . 25.0 107.104 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.91 121.89 39.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.086 -1.079 . . . . 25.0 108.086 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 13.1 mm -77.66 143.2 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.002 -0.74 . . . . 25.0 109.002 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.63 -42.9 27.56 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.971 0.805 . . . . 25.0 109.792 175.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.01 -23.7 65.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 114.075 1.139 . . . . 25.0 114.075 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 45.4 p -139.02 168.82 18.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.967 0.889 . . . . 25.0 110.374 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.4 18.7 1.09 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.181 -0.918 . . . . 25.0 112.246 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -90.06 146.59 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.71 138.6 10.83 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.797 -1.927 . . . . 25.0 105.797 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -138.79 132.97 31.49 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.126 0.421 . . . . 25.0 112.032 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -93.18 115.03 27.67 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.653 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -97.05 112.63 24.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.204 -0.665 . . . . 25.0 109.204 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.1 139.12 37.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.915 -0.584 . . . . 25.0 112.163 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -126.45 135.24 64.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.327 -2.101 . . . . 25.0 105.327 166.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -93.67 132.67 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.614 -1.254 . . . . 25.0 107.614 176.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -133.23 161.69 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.539 0.57 . . . . 25.0 112.539 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -120.98 95.04 4.54 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.784 -2.302 . . . . 25.0 104.784 170.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.7 tp -93.53 160.0 14.98 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 114.157 1.169 . . . . 25.0 114.157 -170.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.3 p -145.9 173.03 12.5 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.567 -0.531 . . . . 25.0 109.567 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.74 0 N-CA-C 108.609 -0.886 . . . . 25.0 108.609 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 15.8 m170 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 121.304 0.573 . . . . 25.0 110.752 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.65 167.52 35.38 Favored Glycine 0 C--N 1.322 -0.218 1 N-CA-C 102.147 -4.381 . . . . 25.0 102.147 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -146.1 166.49 25.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 120.071 1.936 . . . . 25.0 109.915 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.89 124.03 63.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.814 -1.18 . . . . 25.0 107.814 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -40.53 56.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.767 -1.106 . . . . 25.0 110.384 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -153.28 128.21 4.81 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -65.55 134.59 21.38 Favored 'Cis proline' 0 C--N 1.347 0.482 0 CA-C-N 118.814 0.612 . . . . 25.0 110.88 -0.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.09 4.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.105 -0.498 . . . . 25.0 111.079 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.7 p -72.13 164.41 26.23 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -59.55 -22.46 61.73 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.183 0.516 . . . . 25.0 111.777 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.71 -52.93 25.55 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.05 -0.722 . . . . 25.0 109.05 175.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -67.37 -35.07 78.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.019 -0.537 . . . . 25.0 110.928 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -63.97 -32.15 73.58 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.061 -0.4 . . . . 25.0 110.739 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -40.48 96.44 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.418 0.628 . . . . 25.0 109.496 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.58 -34.31 76.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.022 -0.535 . . . . 25.0 110.362 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.5 mt -79.78 5.3 13.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.575 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.49 23.02 10.28 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.029 1.331 . . . . 25.0 113.233 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.459 ' C ' HD21 ' A' ' 19' ' ' ASN . 96.0 mt -88.18 -21.03 24.8 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.741 -1.207 . . . . 25.0 107.741 174.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.459 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.62 159.53 29.07 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 105.148 -2.168 . . . . 25.0 105.148 176.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.4 p -135.16 175.64 9.4 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 122.215 0.206 . . . . 25.0 110.517 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 71.46 5.06 5.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.75 1.759 . . . . 25.0 115.75 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -68.26 -38.95 82.28 Favored 'General case' 0 CA--C 1.501 -0.92 0 O-C-N 121.53 -0.731 . . . . 25.0 111.392 175.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.95 -64.21 1.57 Allowed Glycine 0 C--O 1.218 -0.869 0 O-C-N 123.575 0.547 . . . . 25.0 112.087 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -87.98 -53.29 4.81 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.581 1.181 . . . . 25.0 111.599 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.13 -7.97 9.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.017 -172.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.83 2.74 53.11 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.825 -0.547 . . . . 25.0 111.527 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -119.72 -33.98 3.88 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.949 -0.7 . . . . 25.0 109.98 172.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -126.98 103.9 23.34 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 110.102 -0.333 . . . . 25.0 110.102 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.98 -21.11 21.2 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.034 -1.511 . . . . 25.0 114.678 -175.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.99 12.89 6.72 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.0 m -66.79 -13.77 61.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.829 0.307 . . . . 25.0 111.829 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.469 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 27.8 m -65.72 135.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 113.654 0.983 . . . . 25.0 113.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -153.06 151.55 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -157.92 -172.08 24.65 Favored Glycine 0 C--N 1.328 0.115 0 N-CA-C 110.575 -1.01 . . . . 25.0 110.575 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 tp -127.62 148.29 50.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.011 0.906 . . . . 25.0 112.011 -177.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.63 156.97 33.69 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.008 -1.108 . . . . 25.0 108.008 172.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 134.85 2.36 3.14 Favored Glycine 0 C--O 1.224 -0.489 0 CA-C-N 114.832 -1.076 . . . . 25.0 113.285 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -75.78 141.44 72.06 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 121.536 -0.979 . . . . 25.0 109.757 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -92.07 -18.37 12.98 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 N-CA-C 115.899 1.461 . . . . 25.0 115.899 -5.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -73.13 -35.19 66.47 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.043 1.497 . . . . 25.0 115.043 -168.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.93 38.23 3.72 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.16 -2.163 . . . . 25.0 105.16 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -111.9 -171.77 18.93 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 114.345 -1.298 . . . . 25.0 110.444 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.74 167.27 10.43 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.19 1.926 . . . . 25.0 114.739 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.02 159.97 31.09 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.727 -1.583 . . . . 25.0 106.727 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.11 139.24 57.62 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.287 -1.324 . . . . 25.0 108.914 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.49 -2.91 84.27 Favored Glycine 0 C--O 1.225 -0.415 0 CA-C-N 116.038 -0.528 . . . . 25.0 112.806 -175.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -124.5 11.73 8.63 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.473 -0.936 . . . . 25.0 108.473 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 59.5 mt -65.21 -54.35 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 112.61 0.596 . . . . 25.0 112.61 -171.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.26 -20.17 60.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.874 0.845 . . . . 25.0 108.798 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 t -74.56 -16.26 60.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.962 . . . . 25.0 111.792 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 55.26 26.24 8.3 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.38 0.672 . . . . 25.0 109.94 -172.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.57 35.78 22.66 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.781 1.232 . . . . 25.0 114.106 -176.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -122.3 133.97 54.67 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.183 0.593 . . . . 25.0 111.051 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -59.87 -31.96 70.26 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 115.092 1.515 . . . . 25.0 115.092 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.09 -10.25 58.13 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.191 0.441 . . . . 25.0 112.191 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.469 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 8.4 m-85 -123.63 16.23 9.54 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -71.12 -41.59 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.058 -1.026 . . . . 25.0 111.613 -174.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -73.43 -11.09 60.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.717 0.77 . . . . 25.0 109.722 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -84.26 -6.61 59.42 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -114.83 -34.96 4.95 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.638 0.607 . . . . 25.0 112.638 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -89.42 113.5 24.85 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.651 -0.656 . . . . 25.0 111.094 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.459 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.0 pm0 -121.92 160.99 23.64 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.661 -0.7 . . . . 25.0 109.376 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -119.97 163.88 25.49 Favored Pre-proline 0 C--N 1.317 -0.825 1 N-CA-C 99.95 -4.093 . . . . 25.0 99.95 162.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.92 -5.78 17.11 Favored 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 116.196 -2.069 . . . . 25.0 115.669 -175.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -121.41 9.78 10.39 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.712 0.768 . . . . 25.0 111.115 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -77.78 -28.72 50.61 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.39 -0.819 . . . . 25.0 113.013 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.459 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 13.0 m95 -127.21 167.61 15.84 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.87 0.367 . . . . 25.0 111.717 -177.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -67.75 119.12 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 106.124 -1.806 . . . . 25.0 106.124 167.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -92.54 104.25 16.57 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 100.934 -3.728 . . . . 25.0 100.934 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.75 135.34 54.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.589 -1.187 . . . . 25.0 110.165 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -93.33 102.2 14.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.733 -1.121 . . . . 25.0 108.187 -177.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.6 mt -130.01 173.99 10.2 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.001 -1.111 . . . . 25.0 108.001 -176.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.46 156.89 26.05 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.55 -0.75 . . . . 25.0 111.562 -175.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.1 p -77.17 166.26 23.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.95 -1.5 . . . . 25.0 106.95 173.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.03 -164.5 21.57 Favored Glycine 0 C--O 1.239 0.454 0 N-CA-C 110.677 -0.969 . . . . 25.0 110.677 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.38 134.2 59.83 Favored 'Trans proline' 0 C--N 1.346 0.417 0 CA-C-N 118.972 1.386 . . . . 25.0 114.278 -177.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -140.84 161.66 37.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.309 -1.738 . . . . 25.0 106.309 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.2 p -105.4 152.12 23.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.837 -1.172 . . . . 25.0 107.837 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -139.45 101.02 4.13 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 105.967 -1.864 . . . . 25.0 105.967 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.39 108.77 20.15 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.79 0.805 . . . . 25.0 110.341 -178.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -97.75 148.67 23.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.602 -0.726 . . . . 25.0 110.094 -178.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -127.25 116.33 20.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 104.205 -2.517 . . . . 25.0 104.205 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -112.26 119.22 37.59 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.455 -0.793 . . . . 25.0 110.573 -173.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.01 18.58 3.48 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.507 0.67 . . . . 25.0 110.999 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.11 138.23 36.86 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.509 -0.552 . . . . 25.0 109.509 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -86.07 -7.15 58.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.488 0.922 . . . . 25.0 113.488 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.57 154.49 32.48 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.457 0.54 . . . . 25.0 112.457 -176.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.9 t -72.7 155.94 39.47 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -173.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.419 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.7 t -97.97 158.35 15.59 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 173.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.7 -14.98 10.17 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.041 0.213 . . . . 25.0 111.182 171.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -173.28 153.3 2.4 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.866 0.365 . . . . 25.0 111.826 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.07 139.08 54.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.225 -2.509 . . . . 25.0 104.225 166.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -143.08 148.18 36.24 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -137.92 132.36 32.29 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -149.52 164.01 36.25 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.65 0.659 . . . . 25.0 110.517 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.29 164.12 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -167.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.6 p -77.89 163.5 25.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.18 155.15 47.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.221 -0.899 . . . . 25.0 109.703 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -68.87 -23.01 35.56 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 117.404 -1.264 . . . . 25.0 113.633 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -113.09 32.07 5.99 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.607 0.363 . . . . 25.0 111.476 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.507 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 3.8 p-90 -82.28 163.06 22.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.674 0.75 . . . . 25.0 111.044 -177.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -93.28 100.98 13.23 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.096 -0.956 . . . . 25.0 110.574 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.507 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -74.01 19.92 0.11 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.817 1.784 . . . . 25.0 115.817 -175.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -112.52 -6.28 13.97 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 174.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -100.25 157.09 34.45 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.449 -0.796 . . . . 25.0 109.286 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 159.08 54.03 Favored 'Trans proline' 0 C--N 1.346 0.426 0 O-C-N 121.962 0.453 . . . . 25.0 112.241 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.98 99.95 1.89 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.076 0.465 . . . . 25.0 111.115 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.6 p -99.14 154.65 17.97 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.604 -0.887 . . . . 25.0 108.604 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -65.59 -25.62 67.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.255 0.55 . . . . 25.0 110.635 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.18 -25.19 63.31 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 25.0 111.973 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 30.8 t -89.6 -3.1 58.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.819 0.343 . . . . 25.0 111.597 -178.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -101.09 152.38 20.68 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.903 1.075 . . . . 25.0 113.903 -175.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -100.16 95.23 6.68 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 103.108 -2.923 . . . . 25.0 103.108 164.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -67.65 -6.4 20.32 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.195 1.183 . . . . 25.0 114.195 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.16 125.36 85.22 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 109.12 -0.696 . . . . 25.0 109.12 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -72.86 148.57 46.14 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 115.14 -2.773 . . . . 25.0 111.554 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -100.64 -14.77 18.0 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.5 m -147.35 64.42 1.15 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.568 -0.287 . . . . 25.0 111.101 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -89.08 138.59 31.28 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.457 -1.297 . . . . 25.0 108.825 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.59 99.54 6.05 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 103.552 -2.759 . . . . 25.0 103.552 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -92.09 91.87 8.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.692 -1.225 . . . . 25.0 107.692 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -110.25 118.03 35.26 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.67 80.46 0.46 Allowed Glycine 0 CA--C 1.502 -0.744 0 CA-C-N 115.459 -0.791 . . . . 25.0 113.791 -169.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.34 18.9 6.02 Favored Glycine 0 C--N 1.321 -0.263 0 C-N-CA 120.941 -0.647 . . . . 25.0 113.443 178.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.86 106.89 6.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.614 0.721 . . . . 25.0 109.427 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.1 mt -70.73 122.7 87.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 105.834 -1.913 . . . . 25.0 105.834 176.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.5 169.24 21.39 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 118.125 -0.783 . . . . 25.0 113.94 -174.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.427 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -95.0 22.54 6.46 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.852 -0.613 . . . . 25.0 109.542 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.55 -17.46 0.28 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 125.716 1.607 . . . . 25.0 112.739 -176.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.8 mt-30 -128.96 150.06 50.55 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 103.172 -2.899 . . . . 25.0 103.172 168.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.9 t -140.33 94.99 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 38.1 m -89.64 121.5 31.88 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 174.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -132.33 166.95 20.76 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.63 -1.248 . . . . 25.0 107.63 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -132.83 155.73 48.45 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.432 -1.692 . . . . 25.0 106.432 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.48 160.53 23.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 47.7 m-20 -103.94 119.69 39.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.466 0.174 . . . . 25.0 110.57 -177.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.1 mt -76.69 131.06 74.69 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 107.117 -1.438 . . . . 25.0 107.117 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.65 145.92 91.88 Favored 'Trans proline' 0 C--N 1.352 0.751 0 CA-C-O 121.668 0.612 . . . . 25.0 113.384 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.83 -26.48 40.45 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.316 -0.856 . . . . 25.0 112.625 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -82.38 7.11 14.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.6 -0.727 . . . . 25.0 110.275 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -118.59 51.82 1.07 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.268 -1.012 . . . . 25.0 108.268 172.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 9.3 p -85.89 170.99 11.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 106.086 -1.82 . . . . 25.0 106.086 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.01 -171.34 37.2 Favored Glycine 0 N--CA 1.452 -0.259 0 N-CA-C 115.444 0.937 . . . . 25.0 115.444 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.2 t -86.05 109.68 18.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.391 0.615 . . . . 25.0 110.512 -169.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.41 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.3 p-80 -158.26 171.06 20.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.974 -0.557 . . . . 25.0 111.941 -175.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.6 p -104.2 150.58 7.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.1 mt -133.25 121.92 43.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.6 132.91 52.06 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.608 -0.724 . . . . 25.0 109.78 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.25 135.23 53.27 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.193 -0.669 . . . . 25.0 109.193 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.98 144.6 37.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.922 0.868 . . . . 25.0 112.531 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.419 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 13.3 t90 -113.28 112.37 23.6 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.121 -1.807 . . . . 25.0 106.121 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -92.62 125.23 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.0 mm -81.46 141.53 15.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 109.578 -0.527 . . . . 25.0 109.578 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.46 -43.05 24.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.868 0.758 . . . . 25.0 110.409 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -23.92 64.69 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.611 0.967 . . . . 25.0 113.611 -172.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.4 p -138.86 169.99 16.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.912 0.863 . . . . 25.0 109.91 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.05 20.32 0.81 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.223 -0.899 . . . . 25.0 112.189 178.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -90.01 145.9 24.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.592 -0.693 . . . . 25.0 112.731 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.66 136.81 7.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.343 -1.725 . . . . 25.0 106.343 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -137.87 130.33 29.39 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.482 0.549 . . . . 25.0 112.482 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.07 117.59 28.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.65 -0.704 . . . . 25.0 110.605 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -97.13 115.91 28.39 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.801 -1.185 . . . . 25.0 107.801 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.95 142.97 27.59 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.8 136.7 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 104.505 -2.405 . . . . 25.0 104.505 166.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -99.47 129.83 45.68 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.0 m -133.5 162.19 40.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -116.03 95.05 4.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.912 -2.625 . . . . 25.0 103.912 166.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.77 163.09 14.59 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.104 -0.498 . . . . 25.0 112.164 -172.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.6 p -145.98 162.68 37.29 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.847 -0.797 . . . . 25.0 108.847 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.751 0 CA-C-O 118.005 -0.998 . . . . 25.0 111.05 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 m170 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.258 0.552 . . . . 25.0 110.967 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.54 169.98 40.01 Favored Glycine 0 CA--C 1.509 -0.333 1 N-CA-C 102.839 -4.104 . . . . 25.0 102.839 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -145.13 167.28 23.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.891 1.845 . . . . 25.0 109.3 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.75 124.67 64.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.477 -0.935 . . . . 25.0 108.477 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -75.2 -43.5 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.661 -1.154 . . . . 25.0 109.96 -175.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.5 t -152.74 129.27 5.43 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 105.798 -1.927 . . . . 25.0 105.798 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -64.77 132.87 15.45 Favored 'Cis proline' 0 C--N 1.346 0.4 0 CA-C-N 118.791 0.604 . . . . 25.0 110.895 -0.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 109.67 2.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.039 -0.528 . . . . 25.0 111.953 -172.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 t -72.01 157.71 37.32 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -55.25 -25.25 32.46 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.562 0.745 . . . . 25.0 111.828 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.16 -53.52 36.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.659 0.742 . . . . 25.0 109.431 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -67.75 -35.04 78.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.714 -0.675 . . . . 25.0 110.626 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -63.56 -32.35 73.79 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 122.076 -0.39 . . . . 25.0 110.344 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -39.06 92.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 25.0 110.031 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.73 -35.81 79.43 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.058 -0.519 . . . . 25.0 109.821 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.7 mt -77.91 3.54 14.27 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.179 -0.464 . . . . 25.0 111.623 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 57.92 21.98 8.24 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.242 1.417 . . . . 25.0 113.245 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.457 ' C ' HD21 ' A' ' 19' ' ' ASN . 95.6 mt -84.05 -21.37 31.6 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 172.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.457 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.78 158.59 31.41 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.812 -2.292 . . . . 25.0 104.812 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.6 p -136.6 176.02 9.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.918 -0.401 . . . . 25.0 109.918 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 71.97 5.21 5.28 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.516 1.672 . . . . 25.0 115.516 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 78.6 m -68.54 -36.7 79.17 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 121.585 -0.697 . . . . 25.0 111.154 174.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -62.96 1.45 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.681 0.613 . . . . 25.0 112.378 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.3 t -87.97 -53.74 4.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 122.564 1.173 . . . . 25.0 111.868 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.2 t -67.36 -12.37 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.41 -1.268 . . . . 25.0 113.116 -171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -87.02 -2.26 58.5 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 121.808 -0.557 . . . . 25.0 111.75 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -117.26 -34.53 4.31 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 119.744 -0.782 . . . . 25.0 110.424 172.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -127.04 98.52 30.21 Favored Pre-proline 0 C--O 1.24 0.597 0 N-CA-C 110.414 -0.217 . . . . 25.0 110.414 170.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.83 -20.68 22.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 116.976 -1.549 . . . . 25.0 114.734 -174.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -82.88 8.83 11.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.845 -0.534 . . . . 25.0 112.384 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m -67.68 -14.65 63.12 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.553 0.575 . . . . 25.0 112.553 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 m -64.16 133.05 30.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 121.703 0.763 . . . . 25.0 112.56 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -153.0 156.06 38.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 105.922 -1.881 . . . . 25.0 105.922 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.17 -169.04 23.89 Favored Glycine 0 N--CA 1.453 -0.167 0 N-CA-C 108.98 -1.648 . . . . 25.0 108.98 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -128.2 148.65 50.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.148 0.974 . . . . 25.0 111.474 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.82 157.05 31.44 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 107.473 -1.306 . . . . 25.0 107.473 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -3.47 2.19 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.751 -1.113 . . . . 25.0 112.484 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -75.89 145.5 77.88 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 108.397 -0.964 . . . . 25.0 108.397 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.75 -19.16 12.07 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 N-CA-C 116.255 1.598 . . . . 25.0 116.255 -4.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -76.61 -35.26 58.18 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.724 1.379 . . . . 25.0 114.724 -169.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.0 30.35 7.11 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.58 -176.22 43.01 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.349 -1.296 . . . . 25.0 110.978 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -62.24 171.15 5.54 Favored 'Trans proline' 0 C--O 1.241 0.626 0 C-N-CA 122.796 2.331 . . . . 25.0 113.934 178.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 159.97 30.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 106.859 -1.534 . . . . 25.0 106.859 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.77 138.17 58.13 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 107.192 -1.41 . . . . 25.0 107.192 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.39 85.67 Favored Glycine 0 C--O 1.229 -0.21 0 C-N-CA 121.468 -0.396 . . . . 25.0 112.962 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -124.92 10.9 8.29 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.742 -0.466 . . . . 25.0 109.742 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 63.3 mt -64.95 -49.15 81.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 122.217 -0.302 . . . . 25.0 111.486 -173.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.24 -21.22 56.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.073 0.463 . . . . 25.0 109.898 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.7 p -83.46 -8.65 59.33 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.569 0.581 . . . . 25.0 112.569 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.63 32.6 12.09 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.556 0.742 . . . . 25.0 110.176 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.34 38.28 25.89 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.727 1.38 . . . . 25.0 114.727 -176.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.54 137.02 54.61 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.023 0.529 . . . . 25.0 110.942 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.41 -35.78 80.3 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 115.135 1.532 . . . . 25.0 115.135 -174.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -70.95 -7.18 44.16 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.529 0.566 . . . . 25.0 112.529 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.402 ' HA ' HD11 ' A' ' 59' ' ' LEU . 12.5 m-85 -121.47 11.96 10.74 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -72.55 -35.25 67.97 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.891 -1.131 . . . . 25.0 110.218 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.9 mp0 -70.83 -16.05 62.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.889 0.852 . . . . 25.0 109.576 174.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.402 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.82 -3.8 58.91 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.789 -0.819 . . . . 25.0 108.789 -177.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -115.1 -32.13 5.81 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.293 0.479 . . . . 25.0 112.293 173.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -91.64 118.08 30.31 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 121.496 -0.752 . . . . 25.0 109.854 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.45 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.9 pm0 -124.06 161.0 26.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.921 -0.581 . . . . 25.0 110.13 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -120.0 162.71 31.97 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 100.25 -3.981 . . . . 25.0 100.25 163.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.06 -7.17 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.775 -1.683 . . . . 25.0 115.786 -175.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -125.18 10.73 8.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.225 0.536 . . . . 25.0 112.018 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -77.32 -28.47 53.19 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.723 -0.61 . . . . 25.0 112.551 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.45 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 12.3 m95 -125.11 165.85 17.47 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 120.656 0.265 . . . . 25.0 110.814 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -68.83 120.97 15.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.97 -1.863 . . . . 25.0 105.97 170.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -94.48 103.87 15.83 Favored 'General case' 0 CA--C 1.499 -1.007 1 N-CA-C 99.997 -4.075 . . . . 25.0 99.997 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -66.19 134.58 53.02 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.024 -0.989 . . . . 25.0 110.512 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.83 99.42 12.29 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.715 -1.217 . . . . 25.0 107.715 -178.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.2 mt -130.9 173.94 10.47 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.275 -1.75 . . . . 25.0 106.275 -176.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -113.4 163.73 14.5 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.786 1.032 . . . . 25.0 113.786 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.9 p -77.05 170.81 15.86 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.745 -1.57 . . . . 25.0 106.953 175.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.09 -161.72 29.32 Favored Glycine 0 C--O 1.241 0.581 0 N-CA-C 111.144 -0.782 . . . . 25.0 111.144 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.68 131.34 41.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 118.935 1.368 . . . . 25.0 114.132 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -138.01 160.48 39.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.342 -1.725 . . . . 25.0 106.342 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.3 p -99.39 150.35 22.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.527 -1.286 . . . . 25.0 107.527 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -137.61 100.98 4.35 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 105.54 -2.022 . . . . 25.0 105.54 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.68 112.57 25.33 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.367 -0.833 . . . . 25.0 109.988 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.3 m95 -101.7 151.65 21.78 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 25.0 110.051 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -128.61 114.33 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 104.89 -2.263 . . . . 25.0 104.89 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -116.8 117.98 31.26 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.8 0.84 . . . . 25.0 112.085 -173.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.72 -32.71 69.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.454 0.645 . . . . 25.0 109.828 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.96 106.08 17.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 25.0 110.704 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -70.09 -0.12 7.11 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 115.161 1.541 . . . . 25.0 115.161 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.34 158.32 36.55 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.607 0.241 . . . . 25.0 111.613 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.2 t -67.79 156.09 37.82 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 116.053 1.872 . . . . 25.0 116.053 -170.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.437 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.5 t -99.1 161.05 13.84 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 114.856 -1.066 . . . . 25.0 108.241 172.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 t -117.97 -15.48 9.95 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.114 0.259 . . . . 25.0 111.081 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 t -172.81 155.39 3.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.965 0.412 . . . . 25.0 111.793 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 57.6 m95 -126.67 137.44 53.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 105.137 -2.171 . . . . 25.0 105.137 166.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -139.87 146.15 38.94 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.447 -0.945 . . . . 25.0 108.447 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -137.47 133.7 34.94 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.543 -1.651 . . . . 25.0 106.543 -176.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.99 161.49 42.23 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.557 0.617 . . . . 25.0 110.562 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.4 163.13 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 114.145 1.165 . . . . 25.0 114.145 -168.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.1 p -77.71 159.85 28.83 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.216 -1.031 . . . . 25.0 108.216 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -62.74 157.66 57.29 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.909 -1.042 . . . . 25.0 109.575 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -69.59 -18.24 37.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 N-CA-C 114.861 1.062 . . . . 25.0 114.861 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -118.73 31.85 6.44 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.615 0.366 . . . . 25.0 111.985 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.504 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -76.72 163.17 27.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.723 0.773 . . . . 25.0 111.5 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -85.95 101.31 12.78 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.899 -1.046 . . . . 25.0 110.297 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.504 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.82 21.67 0.66 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 116.059 1.874 . . . . 25.0 116.059 -173.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.0 t -125.36 0.42 7.69 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.475 0.655 . . . . 25.0 109.669 173.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -103.61 158.81 31.08 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.478 -0.934 . . . . 25.0 108.478 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.62 156.01 67.69 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 121.863 0.401 . . . . 25.0 112.66 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.76 100.87 1.58 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.964 0.412 . . . . 25.0 111.817 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 57.8 p -94.14 152.66 18.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -66.21 -25.17 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.342 0.592 . . . . 25.0 110.804 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.76 -24.61 63.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.348 -0.842 . . . . 25.0 112.093 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.9 t -83.35 -5.24 59.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.709 0.29 . . . . 25.0 111.777 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -102.94 154.02 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.344 1.238 . . . . 25.0 114.344 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -95.33 96.46 9.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 103.167 -2.901 . . . . 25.0 103.167 164.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.1 mt -69.01 -6.67 29.38 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -171.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.46 123.0 83.15 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 108.57 -0.9 . . . . 25.0 108.57 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 139.54 35.07 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 115.059 -2.827 . . . . 25.0 112.148 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -92.2 -12.51 32.56 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -176.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.3 m -147.58 66.88 1.12 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.317 -0.401 . . . . 25.0 110.071 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.01 135.05 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 118.727 -1.189 . . . . 25.0 108.978 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -125.18 99.39 6.07 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.895 -2.631 . . . . 25.0 103.895 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -91.16 91.91 8.44 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 106.694 -1.595 . . . . 25.0 106.694 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -111.76 116.99 31.62 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.114 0.959 . . . . 25.0 108.568 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.73 81.58 0.43 Allowed Glycine 0 CA--C 1.501 -0.818 0 CA-C-N 115.004 -0.998 . . . . 25.0 112.312 -172.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.14 15.04 4.81 Favored Glycine 0 C--O 1.228 -0.276 0 C-N-CA 120.867 -0.682 . . . . 25.0 114.086 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.01 104.06 5.44 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.266 -1.013 . . . . 25.0 108.266 176.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.4 mt -78.74 122.06 84.29 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 107.62 -1.252 . . . . 25.0 107.62 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.0 160.84 42.32 Favored 'Trans proline' 0 C--N 1.347 0.451 0 CA-C-O 121.505 0.544 . . . . 25.0 113.478 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.98 31.95 3.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.78 -4.58 1.66 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 113.618 -1.628 . . . . 25.0 111.435 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.06 152.33 48.71 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.438 -2.43 . . . . 25.0 104.438 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.5 t -141.39 95.09 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.221 -1.77 . . . . 25.0 106.221 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.8 t -85.43 140.98 30.29 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 104.69 -2.337 . . . . 25.0 104.69 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -156.98 166.91 32.02 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.81 -1.541 . . . . 25.0 108.705 -176.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -134.11 157.57 45.82 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.17 160.49 30.2 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -105.61 115.55 30.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.068 0.23 . . . . 25.0 111.034 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.2 mt -77.38 132.62 69.24 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 108.058 -1.09 . . . . 25.0 108.058 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.69 146.5 96.69 Favored 'Trans proline' 0 C--N 1.353 0.791 0 N-CA-C 113.766 0.641 . . . . 25.0 113.766 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -82.2 -25.78 33.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.164 -0.925 . . . . 25.0 112.768 -170.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -83.83 9.83 11.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.684 0.754 . . . . 25.0 110.115 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.2 mmt-85 -116.31 58.08 0.76 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.221 -1.029 . . . . 25.0 108.221 172.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.2 p -86.0 170.85 11.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 107.551 -1.278 . . . . 25.0 107.551 175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 81.89 -163.25 43.59 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.851 1.101 . . . . 25.0 115.851 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.1 t -85.71 107.45 17.59 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.288 0.566 . . . . 25.0 110.693 -168.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -156.29 169.71 23.93 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.018 -0.537 . . . . 25.0 111.32 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -107.74 151.27 9.84 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.42 120.8 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.14 -2.17 . . . . 25.0 105.14 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -105.18 138.59 41.15 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.513 -0.767 . . . . 25.0 109.955 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -131.84 140.29 49.09 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.166 -0.679 . . . . 25.0 109.166 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -128.59 140.37 49.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.879 0.847 . . . . 25.0 112.358 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.437 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 16.6 t90 -103.42 113.12 26.37 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.395 -1.705 . . . . 25.0 106.395 173.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -94.48 119.95 33.97 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.4 mm -76.92 142.05 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 O-C-N 122.162 -0.336 . . . . 25.0 110.157 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.72 -44.34 20.96 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.551 0.691 . . . . 25.0 110.177 174.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.07 -24.63 65.08 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.778 1.399 . . . . 25.0 114.778 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.6 p -139.26 170.8 15.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 122.142 0.972 . . . . 25.0 110.648 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 18.79 1.25 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.883 -1.053 . . . . 25.0 112.386 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -89.94 148.87 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.727 -0.608 . . . . 25.0 112.172 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.29 143.0 10.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.619 -1.993 . . . . 25.0 105.619 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -146.83 133.8 20.26 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.192 0.441 . . . . 25.0 112.192 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -92.41 115.87 28.47 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.838 -0.619 . . . . 25.0 111.481 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -97.0 122.77 40.36 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.232 -1.025 . . . . 25.0 108.232 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -98.13 143.61 28.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.291 -0.413 . . . . 25.0 111.771 -177.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -125.72 136.49 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 106.144 -1.799 . . . . 25.0 106.144 167.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -97.06 130.58 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.6 -1.259 . . . . 25.0 107.6 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.74 162.66 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.904 0.705 . . . . 25.0 112.904 -174.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.79 95.07 4.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 104.964 -2.235 . . . . 25.0 104.964 168.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.1 tp -92.31 158.83 15.89 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.259 1.207 . . . . 25.0 114.259 -169.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.3 p -145.9 165.35 29.2 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.622 -0.51 . . . . 25.0 109.622 176.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.76 0 CA-C-O 118.745 -0.645 . . . . 25.0 110.29 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.3 m80 . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 121.739 0.78 . . . . 25.0 110.429 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.98 167.24 31.83 Favored Glycine 0 C--N 1.318 -0.449 1 N-CA-C 100.05 -5.22 . . . . 25.0 100.05 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -144.25 158.61 43.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 120.484 2.142 . . . . 25.0 110.732 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.52 118.94 36.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 106.428 -1.693 . . . . 25.0 106.428 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -75.91 -41.25 52.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.166 -1.379 . . . . 25.0 109.608 -174.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 t -153.97 129.01 4.93 Favored Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 105.745 -1.946 . . . . 25.0 105.745 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -64.37 131.54 12.0 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.991 0.83 . . . . 25.0 111.316 -0.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 114.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.975 -0.557 . . . . 25.0 112.396 -172.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.0 t -71.98 158.0 36.8 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -55.78 -24.31 34.94 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.264 0.626 . . . . 25.0 111.822 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.79 -54.12 36.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.82 0.819 . . . . 25.0 109.288 175.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -69.03 -34.49 75.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.398 -0.819 . . . . 25.0 110.741 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.44 -33.35 75.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.98 -0.45 . . . . 25.0 110.517 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -39.9 95.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.243 0.545 . . . . 25.0 109.873 177.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -66.32 -36.5 83.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.222 0.534 . . . . 25.0 110.061 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.4 mt -77.27 4.87 9.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.41 176.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.53 24.11 11.55 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.309 1.444 . . . . 25.0 112.647 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.442 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.7 mt -88.6 -21.38 24.05 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.841 -1.17 . . . . 25.0 107.841 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.442 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 159.21 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 106.613 -1.625 . . . . 25.0 106.613 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.2 p -132.86 175.48 9.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 122.597 0.359 . . . . 25.0 110.221 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 68.44 5.26 4.68 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.813 1.782 . . . . 25.0 115.813 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.7 m -68.16 -41.08 82.07 Favored 'General case' 0 CA--C 1.501 -0.91 0 O-C-N 121.299 -0.876 . . . . 25.0 111.017 173.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.67 -63.84 1.87 Allowed Glycine 0 C--O 1.218 -0.872 0 O-C-N 123.599 0.562 . . . . 25.0 111.93 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.5 t -87.94 -51.82 5.61 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 122.291 1.043 . . . . 25.0 112.043 -177.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.97 -13.25 16.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 114.867 -1.06 . . . . 25.0 113.141 -172.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.86 -4.1 58.41 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.735 -0.603 . . . . 25.0 111.514 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -115.01 -34.03 5.21 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.419 -0.513 . . . . 25.0 110.322 174.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -126.95 95.57 36.73 Favored Pre-proline 0 C--O 1.243 0.754 0 CA-C-O 120.664 0.269 . . . . 25.0 110.412 171.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.51 -19.44 24.84 Favored 'Trans proline' 0 C--N 1.346 0.413 0 N-CA-C 115.097 1.153 . . . . 25.0 115.097 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -91.34 14.14 15.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -176.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -62.89 -18.7 63.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.15 -0.477 . . . . 25.0 112.233 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.7 m -64.08 116.55 3.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 115.191 1.552 . . . . 25.0 115.191 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -153.09 157.44 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.15 -169.24 22.25 Favored Glycine 0 C--O 1.229 -0.168 0 N-CA-C 108.054 -2.018 . . . . 25.0 108.054 -177.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 tp -112.3 147.43 36.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.493 1.147 . . . . 25.0 112.301 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.76 156.97 31.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.676 -1.231 . . . . 25.0 107.676 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.92 -1.72 2.88 Favored Glycine 0 C--O 1.224 -0.501 0 CA-C-N 114.706 -1.134 . . . . 25.0 112.351 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -75.91 144.82 76.76 Favored Pre-proline 0 C--N 1.321 -0.649 0 O-C-N 121.664 -0.904 . . . . 25.0 110.073 -176.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -91.39 -18.07 14.67 Favored 'Cis proline' 0 CA--C 1.542 0.9 0 N-CA-C 115.585 1.34 . . . . 25.0 115.585 -6.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.46 -36.3 60.7 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.124 1.528 . . . . 25.0 115.124 -168.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.61 40.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.35 -167.58 16.69 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.219 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -59.79 168.27 5.84 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 123.1 2.533 . . . . 25.0 114.052 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.03 31.02 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.872 -1.529 . . . . 25.0 106.872 173.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -57.93 140.81 51.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.784 -1.098 . . . . 25.0 108.443 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.94 -4.05 81.68 Favored Glycine 0 C--O 1.225 -0.41 0 CA-C-N 116.012 -0.54 . . . . 25.0 113.091 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -124.25 10.33 8.66 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.456 -0.942 . . . . 25.0 108.456 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.6 mt -68.45 -51.27 48.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 122.311 -0.243 . . . . 25.0 111.25 -173.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.49 -20.23 60.73 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.886 -0.509 . . . . 25.0 109.772 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 p -84.21 -10.34 57.79 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.388 0.514 . . . . 25.0 112.388 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.42 36.15 15.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.631 0.772 . . . . 25.0 110.136 -171.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.4 t0 61.03 34.01 19.43 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.834 1.42 . . . . 25.0 114.834 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -119.26 135.2 54.81 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.952 -0.468 . . . . 25.0 111.658 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.8 p -61.05 -35.93 78.24 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -72.15 -7.27 48.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.239 0.542 . . . . 25.0 112.408 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.41 ' HA ' HD11 ' A' ' 59' ' ' LEU . 15.2 m-85 -120.39 12.26 11.63 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 107.024 -1.473 . . . . 25.0 107.024 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -72.23 -34.67 68.48 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.151 -0.968 . . . . 25.0 110.117 -175.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -70.09 -17.3 63.21 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 122.023 0.916 . . . . 25.0 110.011 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.2 -4.98 59.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.632 -0.877 . . . . 25.0 108.632 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -113.17 -32.06 6.43 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.096 0.474 . . . . 25.0 111.783 173.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -93.89 115.58 27.97 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.721 -0.612 . . . . 25.0 110.388 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.442 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -126.6 161.0 29.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.163 0.506 . . . . 25.0 109.792 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 13.3 p -118.2 161.99 32.14 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 100.45 -3.907 . . . . 25.0 100.45 162.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.02 -1.65 9.04 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 116.983 -1.545 . . . . 25.0 115.852 -174.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.7 t -127.97 12.57 6.72 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.734 0.778 . . . . 25.0 111.031 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -78.96 -30.06 44.3 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.306 -0.871 . . . . 25.0 113.121 -176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.1 m95 -124.81 165.23 18.38 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 110.309 -0.256 . . . . 25.0 110.309 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -66.44 127.62 33.0 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.454 -2.054 . . . . 25.0 105.454 170.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -101.68 107.96 19.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 100.418 -3.919 . . . . 25.0 100.418 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.19 135.37 53.38 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.915 -1.039 . . . . 25.0 110.139 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -90.41 100.89 13.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.596 -1.261 . . . . 25.0 107.596 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.1 mt -130.24 173.94 10.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.756 -1.572 . . . . 25.0 106.756 -176.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -115.26 166.46 11.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.654 0.74 . . . . 25.0 112.811 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.3 p -77.04 171.02 15.47 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.461 -1.681 . . . . 25.0 106.461 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.36 -162.53 33.49 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 120.585 -0.817 . . . . 25.0 111.452 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.57 131.29 39.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 118.82 1.31 . . . . 25.0 114.628 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -136.07 159.34 42.01 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.693 -1.966 . . . . 25.0 105.693 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.1 p -99.18 151.01 21.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.307 -1.368 . . . . 25.0 107.307 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -138.72 101.05 4.23 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.8 122.69 46.26 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.481 -0.933 . . . . 25.0 108.481 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -108.22 147.51 31.26 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.8 -1.091 . . . . 25.0 109.399 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -126.73 115.12 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.089 -2.559 . . . . 25.0 104.089 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -113.91 132.91 55.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.384 -0.825 . . . . 25.0 111.411 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.8 t -93.06 6.15 48.97 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.428 0.632 . . . . 25.0 109.992 173.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -118.48 138.33 52.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.026 0.441 . . . . 25.0 110.431 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -91.19 -9.19 46.3 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.635 0.606 . . . . 25.0 112.635 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -68.1 157.38 35.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.259 0.466 . . . . 25.0 112.259 -176.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.1 t -75.59 155.97 35.41 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 114.631 1.345 . . . . 25.0 114.631 -172.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.3 t -97.63 158.91 15.24 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.198 -0.91 . . . . 25.0 108.664 173.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -118.02 -15.24 9.94 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.149 0.281 . . . . 25.0 111.63 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 t -171.89 154.13 3.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.009 0.433 . . . . 25.0 111.507 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -127.13 142.01 51.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.537 -2.394 . . . . 25.0 104.537 167.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -147.12 154.57 41.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.668 -0.864 . . . . 25.0 108.668 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -137.96 136.79 37.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 106.379 -1.712 . . . . 25.0 106.379 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.98 161.87 41.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.284 0.493 . . . . 25.0 110.065 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.88 165.79 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 113.927 1.084 . . . . 25.0 113.927 -167.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -79.94 161.13 25.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 169.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.72 158.88 38.4 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.197 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.07 -19.15 39.78 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 117.4 -1.267 . . . . 25.0 114.231 -174.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -120.81 31.92 6.2 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 122.764 0.426 . . . . 25.0 111.554 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.521 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.7 p-90 -73.68 164.39 26.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.934 0.874 . . . . 25.0 112.68 -177.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.18 101.0 10.92 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.657 -1.156 . . . . 25.0 109.847 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.521 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.2 15.96 5.69 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.656 2.095 . . . . 25.0 116.656 -169.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 9.5 t -125.57 9.01 7.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.754 0.788 . . . . 25.0 109.12 176.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.7 156.18 41.92 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 114.585 -1.189 . . . . 25.0 107.943 -174.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.74 155.43 70.54 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 O-C-N 121.953 0.449 . . . . 25.0 111.673 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.41 101.09 2.83 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.587 0.708 . . . . 25.0 112.269 -175.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.9 p -89.59 155.9 18.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.255 -1.017 . . . . 25.0 108.255 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -64.34 -26.64 68.56 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.916 -0.49 . . . . 25.0 111.232 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.05 -25.13 63.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.583 -0.735 . . . . 25.0 112.464 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.8 t -79.44 -10.31 59.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.078 0.399 . . . . 25.0 112.078 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -99.4 155.87 17.31 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 114.323 1.231 . . . . 25.0 114.323 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -94.0 94.98 8.75 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 102.251 -3.24 . . . . 25.0 102.251 161.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.5 mt -66.18 -6.39 13.36 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.812 1.412 . . . . 25.0 114.812 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.5 t -85.75 127.51 62.39 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 108.602 -0.888 . . . . 25.0 108.602 176.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.44 150.3 57.79 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 115.644 -2.437 . . . . 25.0 111.459 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -101.72 -7.79 22.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.095 0.474 . . . . 25.0 111.362 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 57.3 m -148.67 68.95 1.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 25.0 109.764 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -89.08 125.37 34.99 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.705 -0.85 . . . . 25.0 108.705 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -118.92 98.92 6.43 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.058 -2.201 . . . . 25.0 105.058 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -87.96 92.05 8.99 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.019 -0.734 . . . . 25.0 109.019 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -109.67 118.83 37.59 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 106.814 -1.55 . . . . 25.0 106.814 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.54 82.51 0.34 Allowed Glycine 0 CA--C 1.5 -0.869 0 CA-C-N 115.601 -0.727 . . . . 25.0 112.862 -169.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.03 16.37 6.26 Favored Glycine 0 C--N 1.321 -0.293 0 C-N-CA 120.982 -0.628 . . . . 25.0 113.151 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.05 103.94 4.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 121.564 0.697 . . . . 25.0 109.525 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.67 125.29 91.3 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 106.164 -1.791 . . . . 25.0 106.164 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.53 167.47 26.47 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 118.197 -0.736 . . . . 25.0 113.749 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.73 26.95 4.68 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.71 -10.15 0.62 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.82 1.648 . . . . 25.0 111.656 -173.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.461 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.4 mt-30 -131.02 152.38 50.38 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 103.838 -2.652 . . . . 25.0 103.838 170.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -141.49 94.95 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 106.421 -1.696 . . . . 25.0 106.421 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -88.14 140.94 28.98 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 104.749 -2.315 . . . . 25.0 104.749 173.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.7 166.92 27.92 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.101 -1.814 . . . . 25.0 106.101 -177.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -134.49 152.96 52.13 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.722 -2.325 . . . . 25.0 104.722 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 158.86 34.76 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.515 -1.291 . . . . 25.0 107.515 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -105.29 116.58 32.19 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.247 0.342 . . . . 25.0 111.408 -174.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 57.7 mt -77.68 131.94 69.69 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -61.64 147.1 96.16 Favored 'Trans proline' 0 C--N 1.353 0.763 0 N-CA-C 113.762 0.639 . . . . 25.0 113.762 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.74 -27.26 40.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.079 -0.964 . . . . 25.0 112.696 -169.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -83.99 9.77 11.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.62 -0.718 . . . . 25.0 110.185 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -116.2 50.42 1.04 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 172.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 42.3 p -86.07 160.49 19.28 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 175.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 94.4 -168.49 28.24 Favored Glycine 0 C--O 1.237 0.326 0 N-CA-C 114.285 0.474 . . . . 25.0 114.285 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.5 t -86.14 114.89 23.35 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.352 0.596 . . . . 25.0 111.181 -169.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.9 p-80 -160.0 171.7 18.87 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.75 -0.659 . . . . 25.0 110.257 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -107.15 151.6 8.99 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 107.757 -1.201 . . . . 25.0 107.757 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.1 mt -132.93 121.9 45.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.57 129.87 52.6 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.635 -0.712 . . . . 25.0 109.748 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -114.6 130.82 56.82 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 108.973 -0.751 . . . . 25.0 108.973 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 1.7 p -125.46 137.55 57.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 122.043 0.925 . . . . 25.0 112.637 -177.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -111.92 118.46 35.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.77 -1.559 . . . . 25.0 106.954 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -98.63 125.31 43.87 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.539 -0.911 . . . . 25.0 108.539 178.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 21.7 mm -80.55 141.59 15.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.309 -0.626 . . . . 25.0 109.309 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.35 21.65 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.723 0.692 . . . . 25.0 110.476 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.01 -23.72 65.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.993 1.108 . . . . 25.0 113.993 -171.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.2 p -138.95 168.62 19.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.958 0.885 . . . . 25.0 110.248 -174.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.76 28.74 0.33 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.348 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -99.11 145.78 26.8 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.964 0.727 . . . . 25.0 112.964 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.3 146.13 15.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.279 -2.119 . . . . 25.0 105.279 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -148.16 138.11 22.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 111.87 0.322 . . . . 25.0 111.87 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.03 113.22 25.02 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 123.735 0.647 . . . . 25.0 111.205 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -97.06 111.9 23.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.981 -0.748 . . . . 25.0 108.981 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.42 141.13 30.19 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.467 0.543 . . . . 25.0 112.467 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -125.94 135.45 63.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 105.637 -1.986 . . . . 25.0 105.637 166.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -94.43 131.63 39.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.17 -1.419 . . . . 25.0 107.17 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.8 m -132.17 162.01 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.807 0.669 . . . . 25.0 112.807 -175.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -119.74 95.0 4.59 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.392 -2.447 . . . . 25.0 104.392 169.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.17 162.75 14.53 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 112.903 0.705 . . . . 25.0 112.903 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.4 p -145.92 161.1 40.81 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.425 -0.954 . . . . 25.0 108.425 174.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.888 -0.577 . . . . 25.0 110.558 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.476 0.655 . . . . 25.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.17 168.99 37.14 Favored Glycine 0 CA--C 1.509 -0.293 1 N-CA-C 101.691 -4.564 . . . . 25.0 101.691 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 p90 -146.83 165.06 30.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.318 2.059 . . . . 25.0 110.583 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.65 123.33 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.199 -1.037 . . . . 25.0 108.199 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.09 -43.08 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.63 -1.168 . . . . 25.0 109.883 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 t -154.24 129.2 4.94 Favored Pre-proline 0 C--N 1.321 -0.666 0 N-CA-C 106.35 -1.722 . . . . 25.0 106.35 177.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -65.17 131.25 12.46 Favored 'Cis proline' 0 CA--C 1.532 0.418 0 C-N-CA 128.903 0.793 . . . . 25.0 110.92 -0.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.93 112.4 4.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.023 -0.535 . . . . 25.0 112.129 -172.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.9 t -72.23 157.84 36.98 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 107.566 -1.272 . . . . 25.0 107.566 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -55.48 -25.06 34.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.138 0.575 . . . . 25.0 112.238 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.61 -53.48 46.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.807 0.813 . . . . 25.0 109.447 175.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -70.39 -32.46 70.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.63 -0.714 . . . . 25.0 110.925 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -63.51 -32.4 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.847 -0.533 . . . . 25.0 110.374 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -40.3 96.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.38 0.609 . . . . 25.0 109.47 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -66.18 -36.15 82.32 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.887 -0.597 . . . . 25.0 110.206 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -78.24 5.3 10.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 25.0 111.518 177.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 58.35 24.45 11.66 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.158 1.383 . . . . 25.0 112.69 -179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.449 ' C ' HD21 ' A' ' 19' ' ' ASN . 94.6 mt -89.74 -21.65 22.57 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.933 -1.136 . . . . 25.0 107.933 174.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.449 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.93 159.12 28.94 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 106.581 -1.637 . . . . 25.0 106.581 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.2 p -133.04 176.51 8.43 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -175.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 71.94 0.09 3.41 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.624 1.713 . . . . 25.0 115.624 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.1 m -65.95 -43.33 88.29 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 121.633 -0.667 . . . . 25.0 111.745 175.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.73 -63.24 1.94 Allowed Glycine 0 C--O 1.218 -0.891 0 O-C-N 123.598 0.561 . . . . 25.0 111.939 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -87.67 -51.46 5.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.989 0.899 . . . . 25.0 111.857 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.3 t -66.66 -13.2 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.177 -0.92 . . . . 25.0 113.235 -172.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.87 -4.99 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.436 -0.79 . . . . 25.0 111.857 178.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -112.56 -34.07 5.95 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 25.0 109.515 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.3 100.45 29.46 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.399 -0.593 . . . . 25.0 109.399 172.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.1 -19.87 22.34 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.758 -1.028 . . . . 25.0 113.793 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -88.82 15.78 7.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.187 0.439 . . . . 25.0 112.187 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 71.2 m -63.22 -23.13 67.29 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.978 0.418 . . . . 25.0 111.585 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 m -64.04 122.0 14.1 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 115.371 1.619 . . . . 25.0 115.371 -175.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -152.88 159.04 42.98 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 174.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.03 -165.48 17.02 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 108.333 -1.907 . . . . 25.0 108.333 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.04 148.09 45.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.437 1.118 . . . . 25.0 112.546 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -67.27 156.87 35.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.336 -1.357 . . . . 25.0 107.336 171.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.32 -3.49 1.91 Allowed Glycine 0 C--O 1.224 -0.522 0 CA-C-N 114.816 -1.084 . . . . 25.0 112.309 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -75.93 144.06 75.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 O-C-N 121.826 -0.809 . . . . 25.0 108.861 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -91.48 -17.32 15.96 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 N-CA-C 115.581 1.339 . . . . 25.0 115.581 -5.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -70.67 -35.34 72.79 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.73 1.381 . . . . 25.0 114.73 -169.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -119.01 35.14 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.547 -2.02 . . . . 25.0 105.547 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.12 177.21 47.57 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.617 -1.174 . . . . 25.0 111.691 -177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.94 172.2 4.15 Favored 'Trans proline' 0 C--O 1.241 0.635 0 C-N-CA 123.924 3.082 . . . . 25.0 113.821 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.96 159.86 31.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.789 -1.56 . . . . 25.0 106.789 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.17 138.68 57.86 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.258 -1.337 . . . . 25.0 107.438 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.08 -4.7 82.48 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.258 -0.496 . . . . 25.0 113.063 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.2 m170 -124.27 9.27 8.55 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.253 -0.647 . . . . 25.0 109.253 178.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.3 mt -64.87 -49.49 79.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.703 -0.226 . . . . 25.0 111.259 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.58 -29.3 63.4 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 p -77.54 -8.29 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.596 0.962 . . . . 25.0 113.596 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.52 34.26 18.02 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.641 0.776 . . . . 25.0 109.816 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.29 38.51 26.02 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.956 1.465 . . . . 25.0 114.956 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -119.67 134.73 55.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.106 0.562 . . . . 25.0 111.108 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 p -62.29 -34.7 77.09 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.915 1.82 . . . . 25.0 115.915 -173.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.42 -7.66 44.86 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.251 0.548 . . . . 25.0 112.437 -177.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.8 m-85 -122.51 14.23 10.25 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 107.521 -1.289 . . . . 25.0 107.521 -178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.49 -38.17 71.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.227 -0.921 . . . . 25.0 110.405 -176.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -71.5 -17.34 62.35 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 122.032 0.92 . . . . 25.0 109.345 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.2 mp -83.61 -5.94 59.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.553 -0.906 . . . . 25.0 108.553 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -111.82 -32.06 6.74 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -96.58 116.45 29.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 121.471 -0.768 . . . . 25.0 111.127 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.454 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -122.64 160.55 25.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.881 -0.6 . . . . 25.0 109.466 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 6.1 p -116.93 162.57 26.78 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 100.541 -3.874 . . . . 25.0 100.541 162.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.55 -5.38 15.1 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 116.852 -1.632 . . . . 25.0 115.763 -175.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 t -125.67 12.38 7.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.291 0.567 . . . . 25.0 111.419 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -77.67 -29.44 51.55 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.817 0.673 . . . . 25.0 112.817 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.454 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.0 m95 -126.8 168.07 14.93 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 120.674 0.273 . . . . 25.0 110.505 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.0 t-20 -66.77 131.02 45.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 105.436 -2.061 . . . . 25.0 105.436 168.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -104.94 108.09 19.41 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 100.587 -3.857 . . . . 25.0 100.587 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.0 135.83 54.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 114.891 -1.05 . . . . 25.0 110.178 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -92.56 100.22 12.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.626 -1.17 . . . . 25.0 107.91 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.78 173.88 10.71 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.132 -1.803 . . . . 25.0 106.132 -176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -116.09 166.18 12.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.629 0.974 . . . . 25.0 113.629 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.3 p -77.04 169.14 18.87 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.96 -162.25 28.6 Favored Glycine 0 C--O 1.241 0.544 0 N-CA-C 111.078 -0.809 . . . . 25.0 111.078 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.08 133.32 52.46 Favored 'Trans proline' 0 C--N 1.346 0.422 0 CA-C-N 118.889 1.345 . . . . 25.0 114.212 -177.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -138.38 161.62 36.5 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.438 -1.69 . . . . 25.0 106.438 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -104.63 152.29 22.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.216 -1.401 . . . . 25.0 107.216 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -140.77 100.95 3.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.06 -1.83 . . . . 25.0 106.06 -176.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.46 113.8 27.58 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.83 0.824 . . . . 25.0 109.657 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.9 m95 -105.34 152.96 22.28 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.432 -0.804 . . . . 25.0 110.765 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -128.14 114.16 16.65 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.2 mp -115.85 104.92 12.11 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.297 -0.865 . . . . 25.0 112.812 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.9 t -70.91 -22.82 62.2 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.832 -0.803 . . . . 25.0 108.832 171.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.1 98.96 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 175.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -70.04 -18.9 63.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.297 1.221 . . . . 25.0 114.297 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -78.84 167.11 21.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.671 0.619 . . . . 25.0 112.671 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.6 t -64.54 155.54 32.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 117.254 2.316 . . . . 25.0 117.254 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 t -103.52 158.83 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 172.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.97 -12.76 10.07 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.398 0.518 . . . . 25.0 112.398 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.2 t -171.4 151.93 3.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.019 0.438 . . . . 25.0 112.171 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.5 m95 -127.23 139.76 52.69 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.105 -2.554 . . . . 25.0 104.105 167.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -145.82 144.59 30.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.37 -1.344 . . . . 25.0 107.37 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -133.86 134.47 42.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -149.29 163.13 38.56 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.556 -0.535 . . . . 25.0 109.556 178.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.85 165.12 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 113.685 0.994 . . . . 25.0 113.685 -168.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 16.6 p -79.11 161.69 26.33 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 169.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -61.14 159.04 31.54 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 25.0 109.205 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.72 -25.24 34.01 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 116.096 -2.136 . . . . 25.0 113.314 -175.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -114.43 32.06 6.2 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.034 0.534 . . . . 25.0 110.632 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.9 p-90 -73.24 167.41 21.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 122.029 0.918 . . . . 25.0 113.032 -176.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -83.16 101.08 10.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.447 -1.251 . . . . 25.0 109.59 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -93.48 8.56 40.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 14.1 t -118.03 9.76 12.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.401 -0.963 . . . . 25.0 108.401 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -115.11 157.76 42.72 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.115 -1.402 . . . . 25.0 107.599 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -65.67 157.46 58.55 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 O-C-N 121.982 0.464 . . . . 25.0 111.226 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.93 100.95 2.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.227 0.537 . . . . 25.0 111.722 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.1 p -89.31 156.99 18.37 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.305 -1.368 . . . . 25.0 107.305 174.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.66 -24.93 66.35 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.44 0.638 . . . . 25.0 110.762 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.7 -25.96 64.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.996 -1.002 . . . . 25.0 112.914 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 m -80.6 -8.34 59.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 25.0 112.396 -177.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 41.9 m-85 -98.13 154.28 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 115.158 1.54 . . . . 25.0 115.158 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -97.02 96.44 8.48 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 102.614 -3.106 . . . . 25.0 102.614 162.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.92 -7.28 20.94 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -169.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -80.65 132.28 58.56 Favored Pre-proline 0 C--N 1.323 -0.58 0 N-CA-C 109.122 -0.696 . . . . 25.0 109.122 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -73.74 152.3 47.33 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 115.069 -2.821 . . . . 25.0 111.082 177.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -107.46 -11.41 15.51 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.988 0.423 . . . . 25.0 111.49 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.3 m -149.32 67.91 1.03 Allowed 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.317 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.58 138.99 30.99 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.126 -1.03 . . . . 25.0 108.738 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.79 101.04 5.71 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 104.715 -2.328 . . . . 25.0 104.715 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -94.56 92.19 6.95 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.5 -0.926 . . . . 25.0 108.5 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -108.55 122.08 46.31 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 107.067 -1.457 . . . . 25.0 107.067 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.39 37.74 3.4 Favored Glycine 0 C--O 1.224 -0.489 0 N-CA-C 117.129 1.612 . . . . 25.0 117.129 -168.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 162.38 23.92 0.02 OUTLIER Glycine 0 C--N 1.319 -0.389 0 C-N-CA 120.354 -0.927 . . . . 25.0 113.452 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.62 104.16 9.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.381 0.61 . . . . 25.0 110.323 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 91.4 mt -75.47 123.57 88.62 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 104.894 -2.262 . . . . 25.0 104.894 173.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.75 165.34 33.01 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 117.725 -1.05 . . . . 25.0 113.577 -175.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.451 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.8 26.33 3.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 175.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.64 -8.43 0.92 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.987 1.715 . . . . 25.0 111.228 -173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.9 mt-30 -135.04 153.65 51.98 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.064 -2.569 . . . . 25.0 104.064 171.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.72 95.28 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.71 141.94 29.37 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 104.058 -2.571 . . . . 25.0 104.058 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.32 167.03 31.33 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.549 -1.659 . . . . 25.0 109.323 -176.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -134.54 157.38 46.69 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.655 -1.609 . . . . 25.0 106.655 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.46 160.89 26.8 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -108.22 114.98 29.28 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.333 0.396 . . . . 25.0 111.316 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.3 mt -78.58 132.76 64.36 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.68 -0.859 . . . . 25.0 108.68 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -62.35 147.44 94.94 Favored 'Trans proline' 0 C--N 1.354 0.841 0 CA-C-N 118.741 0.586 . . . . 25.0 113.611 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.25 35.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 25.0 112.895 -169.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 p-10 -84.0 9.02 13.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 25.0 110.055 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -116.54 53.43 0.88 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 172.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.5 p -86.91 168.35 13.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 106.525 -1.657 . . . . 25.0 106.525 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 89.67 -167.55 33.76 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 115.535 0.974 . . . . 25.0 115.535 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.2 t -85.84 107.99 17.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.315 0.579 . . . . 25.0 110.707 -169.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -157.12 171.45 20.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.875 -0.602 . . . . 25.0 110.866 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.24 151.25 9.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 N-CA-C 107.816 -1.179 . . . . 25.0 107.816 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.8 mt -131.88 120.64 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 104.758 -2.312 . . . . 25.0 104.758 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.95 130.38 50.0 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.744 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.27 122.27 42.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.487 -0.931 . . . . 25.0 108.487 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.33 140.24 36.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 122.077 0.942 . . . . 25.0 110.197 -178.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -124.25 122.21 37.15 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.25 129.43 50.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 123.238 0.615 . . . . 25.0 109.963 -175.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 43.7 mm -78.06 140.93 16.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.681 -0.489 . . . . 25.0 109.681 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.41 -44.27 25.29 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.773 0.715 . . . . 25.0 111.027 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.26 -23.03 64.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 114.659 1.355 . . . . 25.0 114.659 -172.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.6 p -139.29 170.88 15.13 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.921 0.867 . . . . 25.0 109.707 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.82 23.06 0.56 Allowed 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.365 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -94.2 143.75 26.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.593 -0.692 . . . . 25.0 112.822 -176.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.28 145.58 16.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 104.647 -2.353 . . . . 25.0 104.647 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -147.52 140.01 24.63 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.083 0.771 . . . . 25.0 113.083 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -94.63 112.3 24.05 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.63 0.772 . . . . 25.0 111.496 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -97.06 108.21 20.9 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.38 141.08 29.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.311 -0.859 . . . . 25.0 111.83 -176.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.4 tt -125.58 134.59 66.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.187 -1.783 . . . . 25.0 106.187 167.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.34 130.67 39.02 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.317 -1.364 . . . . 25.0 107.317 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.3 m -131.54 161.19 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 112.81 0.67 . . . . 25.0 112.81 -175.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -118.67 95.1 4.71 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 104.059 -2.571 . . . . 25.0 104.059 168.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -93.14 160.42 14.85 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 113.172 0.804 . . . . 25.0 113.172 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 65.6 p -145.97 167.17 23.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.77 -0.826 . . . . 25.0 108.77 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.869 -0.586 . . . . 25.0 109.94 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.8 m80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.248 -0.278 . . . . 25.0 110.248 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.01 170.59 12.9 Favored Glycine 0 C--N 1.322 -0.201 0 N-CA-C 103.507 -3.837 . . . . 25.0 103.507 -172.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -148.85 169.92 19.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 119.594 1.697 . . . . 25.0 111.385 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 126.11 62.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.031 -1.47 . . . . 25.0 107.031 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.64 -43.01 49.91 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.388 -0.824 . . . . 25.0 109.408 -175.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -153.56 133.57 7.62 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 105.503 -2.036 . . . . 25.0 105.503 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -65.25 135.46 23.53 Favored 'Cis proline' 0 CA--C 1.533 0.469 0 C-N-CA 128.754 0.731 . . . . 25.0 111.999 0.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.17 107.36 1.92 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.773 -0.649 . . . . 25.0 112.431 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 t -71.85 156.69 39.01 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.634 -0.506 . . . . 25.0 109.634 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 -55.4 -25.93 38.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.815 0.846 . . . . 25.0 112.444 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.25 -53.36 45.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.798 0.809 . . . . 25.0 109.134 175.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -66.37 -33.92 76.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.506 -0.77 . . . . 25.0 110.84 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.17 -33.2 75.24 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.948 -0.47 . . . . 25.0 110.244 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -37.52 84.83 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 178.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -62.66 -39.22 93.24 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.257 0.551 . . . . 25.0 109.857 175.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.2 mt -77.45 5.12 9.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.025 -0.534 . . . . 25.0 112.117 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 58.62 22.13 9.48 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.115 1.366 . . . . 25.0 112.814 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.462 ' C ' HD21 ' A' ' 19' ' ' ASN . 95.1 mt -85.2 -20.16 30.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.895 -1.15 . . . . 25.0 107.895 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.462 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -121.81 156.72 32.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.314 -1.735 . . . . 25.0 106.314 177.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 p -134.58 175.98 9.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.366 -0.605 . . . . 25.0 109.366 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 68.08 5.01 4.36 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 175.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.2 m -67.25 -33.15 74.73 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 121.451 -0.781 . . . . 25.0 111.777 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.66 -62.61 1.55 Allowed Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.733 0.645 . . . . 25.0 112.376 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 t -91.75 -50.81 5.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 114.945 1.461 . . . . 25.0 114.945 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.98 -14.28 13.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.122 -1.399 . . . . 25.0 114.12 -165.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -79.45 -7.6 58.53 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.574 -0.85 . . . . 25.0 112.382 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -104.14 -38.92 6.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.229 -0.988 . . . . 25.0 111.048 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -131.21 95.98 23.2 Favored Pre-proline 0 C--O 1.241 0.641 0 N-CA-C 111.785 0.291 . . . . 25.0 111.785 168.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.26 -19.06 29.73 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 116.91 -1.593 . . . . 25.0 115.383 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -81.42 5.57 17.2 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 121.575 -0.703 . . . . 25.0 112.178 -178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.4 m -66.45 -12.35 56.78 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.77 0.656 . . . . 25.0 112.77 177.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.05 132.88 29.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.881 0.848 . . . . 25.0 112.782 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -152.98 150.42 29.21 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.64 -168.38 17.92 Favored Glycine 0 CA--C 1.51 -0.261 0 N-CA-C 109.504 -1.439 . . . . 25.0 109.504 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -127.92 146.64 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.764 0.782 . . . . 25.0 111.174 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.98 157.01 29.42 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.176 -1.046 . . . . 25.0 108.176 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.27 -4.0 1.99 Allowed Glycine 0 C--N 1.318 -0.451 0 CA-C-N 114.726 -1.124 . . . . 25.0 112.847 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -75.96 148.09 81.29 Favored Pre-proline 0 C--N 1.321 -0.632 0 O-C-N 121.623 -0.928 . . . . 25.0 109.075 -177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -90.8 -18.64 14.53 Favored 'Cis proline' 0 CA--C 1.541 0.875 0 N-CA-C 115.95 1.481 . . . . 25.0 115.95 -4.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -77.77 -35.8 51.28 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.924 1.453 . . . . 25.0 114.924 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.02 33.27 5.33 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.364 -1.717 . . . . 25.0 106.364 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.07 -174.86 45.26 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.626 -1.17 . . . . 25.0 111.415 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -60.44 171.5 3.3 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 123.793 2.995 . . . . 25.0 113.322 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.14 159.98 30.99 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.23 137.38 58.0 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 106.652 -1.61 . . . . 25.0 106.652 176.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.21 -6.04 82.7 Favored Glycine 0 CA--C 1.509 -0.298 0 CA-C-O 121.416 0.453 . . . . 25.0 113.413 -174.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 51.0 m170 -125.02 10.04 8.15 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.404 -0.468 . . . . 25.0 110.218 179.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.8 mt -64.23 -48.77 84.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.443 -0.16 . . . . 25.0 111.232 -173.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.81 -24.34 55.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.072 0.463 . . . . 25.0 110.004 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.3 p -81.62 -8.61 59.73 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.031 0.752 . . . . 25.0 113.031 -176.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.89 34.79 17.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.714 0.805 . . . . 25.0 110.075 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.44 41.11 23.33 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -177.818 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -121.34 135.01 55.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.287 0.635 . . . . 25.0 110.781 174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.56 -34.44 77.81 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 115.497 1.665 . . . . 25.0 115.497 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 t -71.42 -8.05 51.32 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.347 0.594 . . . . 25.0 112.346 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.41 ' HA ' HD11 ' A' ' 59' ' ' LEU . 13.3 m-85 -119.1 15.02 13.22 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.447 -1.316 . . . . 25.0 107.447 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.81 -37.89 70.31 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.1 -1.0 . . . . 25.0 110.401 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.4 mp0 -70.2 -16.31 63.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.879 0.847 . . . . 25.0 110.042 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 56' ' ' PHE . 2.4 mp -86.16 -5.72 59.14 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -112.49 -32.31 6.52 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.104 0.409 . . . . 25.0 112.104 173.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -96.07 121.89 38.32 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 121.628 -0.67 . . . . 25.0 110.185 -178.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.454 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -128.03 160.87 30.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.504 -0.771 . . . . 25.0 109.731 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.3 p -114.39 161.19 29.75 Favored Pre-proline 0 C--N 1.319 -0.74 1 N-CA-C 100.11 -4.033 . . . . 25.0 100.11 161.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 -2.16 9.67 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 116.961 -1.56 . . . . 25.0 115.765 -174.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -127.34 11.73 6.94 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.231 0.539 . . . . 25.0 111.65 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -78.93 -31.05 45.05 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.028 0.751 . . . . 25.0 113.028 -176.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.454 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.9 m95 -122.58 167.17 13.73 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 110.047 -0.353 . . . . 25.0 110.047 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -68.19 125.0 24.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.009 -1.848 . . . . 25.0 106.009 172.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -100.44 106.11 17.65 Favored 'General case' 0 CA--C 1.5 -0.981 0 N-CA-C 100.511 -3.885 . . . . 25.0 100.511 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.32 135.75 52.36 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.97 -1.014 . . . . 25.0 110.81 -176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -88.89 100.84 13.49 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 107.912 -1.144 . . . . 25.0 107.912 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.77 174.05 10.33 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.883 -1.895 . . . . 25.0 105.883 -177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -115.42 166.51 11.8 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.687 0.995 . . . . 25.0 113.687 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.5 p -77.12 171.61 14.55 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 106.297 -1.742 . . . . 25.0 106.297 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.99 -161.35 33.05 Favored Glycine 0 C--O 1.24 0.517 0 C-N-CA 120.436 -0.888 . . . . 25.0 111.198 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.09 132.95 50.06 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 119.013 1.406 . . . . 25.0 114.392 -176.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -139.41 158.74 43.62 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.7 p -100.2 150.18 22.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -139.11 100.93 4.15 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 105.527 -2.027 . . . . 25.0 105.527 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.54 111.07 23.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.008 0.909 . . . . 25.0 111.004 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -97.8 147.42 24.41 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.305 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -124.01 110.55 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.602 -2.37 . . . . 25.0 104.602 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.44 130.91 45.74 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.166 -0.925 . . . . 25.0 109.478 -171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.7 t -72.73 -10.92 60.36 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.672 0.619 . . . . 25.0 112.672 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.98 147.6 27.35 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.805 -0.813 . . . . 25.0 108.805 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 mtm180 -81.22 13.68 2.74 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.287 0.847 . . . . 25.0 113.287 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.98 152.36 32.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.956 -0.757 . . . . 25.0 108.956 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.1 t -69.47 155.95 39.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.723 1.009 . . . . 25.0 113.723 -170.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.468 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 3.1 t -102.19 156.55 17.49 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.276 -1.379 . . . . 25.0 107.276 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.84 -15.94 10.0 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.168 0.293 . . . . 25.0 110.771 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 t -172.54 152.08 2.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.891 0.377 . . . . 25.0 111.975 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.67 140.71 52.72 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 103.687 -2.709 . . . . 25.0 103.687 166.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -145.82 150.97 37.15 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.089 0.859 . . . . 25.0 108.978 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -137.98 137.49 37.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.084 -1.821 . . . . 25.0 106.084 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -147.88 160.09 43.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.24 164.5 34.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.217 0.821 . . . . 25.0 113.217 -168.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 p -79.76 162.51 25.1 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.434 -0.95 . . . . 25.0 108.434 171.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -64.06 161.87 35.81 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.249 -0.887 . . . . 25.0 109.472 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.59 -18.73 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 116.505 -1.863 . . . . 25.0 113.812 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.83 32.01 6.16 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.129 0.571 . . . . 25.0 111.034 -177.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.503 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 10.4 p-90 -68.94 172.68 6.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.293 1.22 . . . . 25.0 114.293 -176.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -83.11 98.41 9.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.0 -1.0 . . . . 25.0 109.099 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.503 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -96.27 5.3 51.28 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.913 1.82 . . . . 25.0 115.913 -168.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -128.42 17.22 6.5 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -122.53 161.0 45.99 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 114.195 -1.366 . . . . 25.0 107.503 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.96 151.92 82.05 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 118.443 -0.571 . . . . 25.0 111.133 173.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 108.81 3.44 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.554 0.575 . . . . 25.0 112.554 -175.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.7 p -95.66 153.31 17.79 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.126 -1.065 . . . . 25.0 108.126 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -68.13 -22.59 64.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.422 0.63 . . . . 25.0 110.111 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.81 -29.65 68.87 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.943 -1.026 . . . . 25.0 112.28 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.76 -3.04 59.0 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.045 0.387 . . . . 25.0 112.045 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -100.01 152.27 20.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 114.021 1.119 . . . . 25.0 114.021 -177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -97.02 92.85 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.632 -2.729 . . . . 25.0 103.632 165.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.0 mt -66.66 -6.49 15.72 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.564 1.32 . . . . 25.0 114.564 -170.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.43 122.02 78.69 Favored Pre-proline 0 C--N 1.323 -0.543 0 N-CA-C 108.856 -0.794 . . . . 25.0 108.856 176.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.85 135.6 28.22 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 115.26 -2.693 . . . . 25.0 111.945 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -87.0 -13.62 43.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 -175.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.2 m -146.55 63.32 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.508 -0.314 . . . . 25.0 111.828 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -89.07 134.92 33.82 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 118.152 -1.419 . . . . 25.0 108.874 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -122.58 98.99 6.17 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 104.239 -2.504 . . . . 25.0 104.239 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -90.32 92.05 8.75 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.045 -1.095 . . . . 25.0 108.045 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -106.31 122.06 45.49 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.75 84.11 0.39 Allowed Glycine 0 CA--C 1.504 -0.602 0 CA-C-N 115.123 -0.944 . . . . 25.0 112.811 -171.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.56 15.63 13.31 Favored Glycine 0 C--N 1.32 -0.337 0 C-N-CA 120.901 -0.666 . . . . 25.0 113.464 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.13 106.73 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.366 -0.976 . . . . 25.0 108.366 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 79.2 mt -72.48 117.58 60.2 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 107.583 -1.266 . . . . 25.0 107.583 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -76.94 166.89 26.11 Favored 'Trans proline' 0 C--N 1.345 0.35 0 N-CA-C 114.682 0.993 . . . . 25.0 114.682 -176.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.427 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.44 26.39 4.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.763 -0.829 . . . . 25.0 108.763 178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.72 -16.89 0.37 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.688 1.595 . . . . 25.0 112.33 -175.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.3 mt-30 -129.31 146.96 51.11 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 103.988 -2.597 . . . . 25.0 103.988 172.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.8 t -138.71 95.03 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -89.26 132.66 34.79 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 104.662 -2.348 . . . . 25.0 104.662 173.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -145.2 166.98 23.88 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -175.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -132.11 156.39 46.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.85 159.87 33.03 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -104.67 119.03 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.08 0.238 . . . . 25.0 111.191 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.27 132.81 61.7 Favored Pre-proline 0 C--O 1.24 0.6 0 N-CA-C 108.276 -1.009 . . . . 25.0 108.276 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -60.64 147.41 94.83 Favored 'Trans proline' 0 C--N 1.354 0.844 0 N-CA-C 113.84 0.669 . . . . 25.0 113.84 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.41 -26.46 35.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.159 -0.928 . . . . 25.0 112.717 -169.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -83.63 10.35 9.4 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.744 0.783 . . . . 25.0 110.208 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -115.97 51.4 0.96 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.43 -0.952 . . . . 25.0 108.43 172.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.4 p -86.24 162.22 18.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.582 -1.636 . . . . 25.0 106.582 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.6 -165.68 29.9 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 114.839 0.696 . . . . 25.0 114.839 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 37.4 t -85.85 110.85 19.68 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.491 0.662 . . . . 25.0 110.954 -168.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -157.39 170.98 21.22 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 115.72 -0.673 . . . . 25.0 110.493 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.63 151.54 11.88 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 107.725 -1.213 . . . . 25.0 107.725 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 58.8 mt -131.55 121.27 47.7 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 104.809 -2.293 . . . . 25.0 104.809 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -103.05 128.76 49.8 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.663 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.43 131.59 56.27 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 123.005 0.522 . . . . 25.0 109.804 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.42 145.76 34.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 122.125 0.965 . . . . 25.0 112.249 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.468 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 12.7 t90 -116.77 119.37 35.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 173.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.81 121.41 38.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 7.4 mm -77.28 143.51 12.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.156 -1.053 . . . . 25.0 108.156 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.54 -41.02 28.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.847 0.749 . . . . 25.0 109.637 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.16 -22.69 64.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.011 1.115 . . . . 25.0 114.011 -172.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -138.5 169.14 18.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.993 0.902 . . . . 25.0 110.236 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 17.96 1.45 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.162 -0.926 . . . . 25.0 111.969 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -90.03 144.65 25.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.915 0.709 . . . . 25.0 112.915 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.49 141.34 14.62 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.089 -2.189 . . . . 25.0 105.089 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -146.51 131.85 18.55 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 117.766 0.257 . . . . 25.0 111.432 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -89.95 117.32 28.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.955 -0.566 . . . . 25.0 110.916 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -96.96 107.99 20.62 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.1 140.79 32.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.641 -0.709 . . . . 25.0 111.999 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 134.4 66.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.404 -1.702 . . . . 25.0 106.404 168.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -92.47 132.21 36.98 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.886 -1.153 . . . . 25.0 107.886 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -133.54 161.74 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -176.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -120.64 95.0 4.54 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.637 -2.357 . . . . 25.0 104.637 169.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.58 160.1 16.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 113.277 0.843 . . . . 25.0 113.277 -170.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.4 p -145.8 166.58 25.51 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.821 -0.437 . . . . 25.0 109.821 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.709 -0.662 . . . . 25.0 110.333 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 47.0 m170 . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.963 0.411 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.66 30.97 Favored Glycine 0 N--CA 1.45 -0.377 1 N-CA-C 102.709 -4.156 . . . . 25.0 102.709 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -147.32 168.52 21.57 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 119.523 1.662 . . . . 25.0 109.276 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -105.28 122.83 59.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 108.147 -1.057 . . . . 25.0 108.147 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -72.22 -42.69 65.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.845 -1.071 . . . . 25.0 109.697 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 t -153.02 129.24 5.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -64.67 134.46 19.29 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 128.798 0.749 . . . . 25.0 111.585 -0.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 113.17 4.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.626 0.602 . . . . 25.0 112.626 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.448 ' HG ' ' HB3' ' A' ' 162' ' ' GLN . 14.2 t -72.11 155.03 40.73 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.104 -0.702 . . . . 25.0 109.104 -178.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -56.74 -26.38 57.03 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.286 0.635 . . . . 25.0 112.163 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -48.41 63.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -66.38 -36.65 83.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.624 -0.716 . . . . 25.0 109.638 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.84 -33.43 75.66 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 122.228 -0.295 . . . . 25.0 110.587 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -39.64 93.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 25.0 109.96 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -66.63 -35.37 80.01 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.211 0.529 . . . . 25.0 110.071 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.4 mt -79.4 6.42 10.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.485 . . . . 25.0 111.731 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 59.09 21.45 9.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.056 1.343 . . . . 25.0 113.314 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.456 ' C ' HD21 ' A' ' 19' ' ' ASN . 92.5 mt -87.75 -20.62 25.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.996 -1.113 . . . . 25.0 107.996 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.456 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.0 m120 -123.33 158.95 29.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.075 -2.194 . . . . 25.0 105.075 176.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.1 p -135.38 174.68 10.34 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 122.307 0.243 . . . . 25.0 110.447 -175.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 69.71 5.08 5.03 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.978 1.844 . . . . 25.0 115.978 174.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.1 m -66.8 -39.25 87.69 Favored 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 121.483 -0.761 . . . . 25.0 110.491 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.87 -64.19 1.55 Allowed Glycine 0 C--O 1.217 -0.965 0 O-C-N 123.593 0.558 . . . . 25.0 112.303 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 t -88.01 -53.69 4.6 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.655 1.217 . . . . 25.0 111.592 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.95 -6.9 7.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.32 -1.309 . . . . 25.0 113.377 -171.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.34 2.59 52.21 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.08 -0.387 . . . . 25.0 111.508 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -116.78 -37.93 3.54 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.4 -0.92 . . . . 25.0 111.383 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -127.51 93.68 39.99 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 122.047 0.139 . . . . 25.0 111.35 167.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.19 -19.33 34.23 Favored 'Trans proline' 0 C--N 1.343 0.28 0 N-CA-C 115.614 1.351 . . . . 25.0 115.614 -177.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -82.44 4.95 22.16 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.703 -0.623 . . . . 25.0 112.398 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.1 m -68.55 -9.61 50.48 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 m -64.04 136.65 26.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 122.176 0.988 . . . . 25.0 112.916 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -153.02 160.26 42.97 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 103.742 -2.688 . . . . 25.0 103.742 177.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.84 -170.97 27.31 Favored Glycine 0 C--O 1.226 -0.389 0 N-CA-C 108.439 -1.865 . . . . 25.0 108.439 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.74 145.35 49.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 118.811 1.306 . . . . 25.0 112.142 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -66.57 156.98 33.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.24 1.66 2.81 Favored Glycine 0 C--O 1.224 -0.528 0 CA-C-N 114.921 -1.036 . . . . 25.0 113.114 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -76.06 140.86 70.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 121.633 -0.922 . . . . 25.0 108.848 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -92.66 -15.41 17.52 Favored 'Cis proline' 0 CA--C 1.544 0.993 0 N-CA-C 115.603 1.347 . . . . 25.0 115.603 -5.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.87 -36.3 72.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.878 1.436 . . . . 25.0 114.878 -169.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.15 30.21 7.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 105.612 -1.996 . . . . 25.0 105.612 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.57 -177.2 40.0 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 114.376 -1.284 . . . . 25.0 110.835 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -62.3 170.75 6.12 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.706 2.27 . . . . 25.0 113.445 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 159.95 31.1 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.381 -1.34 . . . . 25.0 107.381 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -61.41 139.08 58.26 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.767 -1.568 . . . . 25.0 106.767 174.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.52 -6.1 83.09 Favored Glycine 0 C--O 1.228 -0.228 0 CA-C-N 116.047 -0.524 . . . . 25.0 112.439 -173.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -126.2 11.19 7.54 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.53 -0.394 . . . . 25.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.28 -52.18 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 122.209 -0.307 . . . . 25.0 111.556 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.59 -21.52 57.74 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.75 -0.463 . . . . 25.0 109.75 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.6 p -81.94 -8.87 59.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.1 32.01 12.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.519 0.728 . . . . 25.0 110.292 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.94 36.83 24.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.557 1.317 . . . . 25.0 114.557 -176.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -119.82 133.31 55.64 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.927 0.491 . . . . 25.0 110.615 175.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.4 p -61.12 -33.08 72.81 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.126 1.158 . . . . 25.0 114.126 -175.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -66.24 -15.97 63.63 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.48 0.657 . . . . 25.0 112.076 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -117.25 14.31 14.78 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.744 -0.835 . . . . 25.0 108.744 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -71.16 -38.76 72.17 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.895 -1.128 . . . . 25.0 111.325 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.3 mp0 -71.31 -13.66 61.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.803 0.811 . . . . 25.0 109.677 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 mp -88.02 -4.65 58.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.693 -0.854 . . . . 25.0 108.693 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -113.11 -32.58 6.28 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.842 0.682 . . . . 25.0 112.842 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -97.09 123.08 40.75 Favored 'General case' 0 CA--C 1.507 -0.71 0 O-C-N 121.534 -0.729 . . . . 25.0 109.845 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.445 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -124.96 160.94 27.75 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.193 -0.912 . . . . 25.0 110.006 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -119.01 161.14 37.97 Favored Pre-proline 0 C--N 1.317 -0.815 1 N-CA-C 100.087 -4.042 . . . . 25.0 100.087 163.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.41 -5.31 15.68 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 116.924 -1.584 . . . . 25.0 115.64 -174.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.6 t -124.64 10.73 8.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.198 0.523 . . . . 25.0 111.7 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -78.17 -30.14 48.95 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.726 -0.609 . . . . 25.0 112.474 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.445 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.0 m95 -123.74 165.4 17.33 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.536 0.208 . . . . 25.0 110.646 -177.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -68.12 128.51 36.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.79 -1.929 . . . . 25.0 105.79 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.5 mmtt -101.33 106.49 17.67 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 100.929 -3.73 . . . . 25.0 100.929 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.02 135.58 52.51 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.022 -0.99 . . . . 25.0 110.511 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -89.88 101.49 14.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.738 -1.119 . . . . 25.0 107.985 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -130.68 173.86 10.49 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.632 -1.247 . . . . 25.0 107.632 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -114.69 161.9 17.51 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.275 0.843 . . . . 25.0 113.275 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.3 p -78.15 172.49 13.47 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 106.593 -1.632 . . . . 25.0 106.593 171.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.37 -162.38 32.0 Favored Glycine 0 C--O 1.241 0.562 0 N-CA-C 110.825 -0.91 . . . . 25.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.62 129.91 34.67 Favored 'Trans proline' 0 C--N 1.345 0.382 0 CA-C-N 118.961 1.38 . . . . 25.0 114.514 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -138.71 160.11 40.44 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.6 p -106.44 152.34 23.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -135.82 100.93 4.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.475 -2.417 . . . . 25.0 104.475 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.89 106.99 18.02 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.304 -0.862 . . . . 25.0 110.446 -176.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -92.8 146.94 23.26 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.62 -0.718 . . . . 25.0 109.944 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -127.53 116.08 19.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 103.937 -2.616 . . . . 25.0 103.937 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -116.42 125.6 52.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.535 -0.757 . . . . 25.0 112.689 -173.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.4 t -87.62 5.33 40.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.314 0.578 . . . . 25.0 110.245 173.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.61 116.74 21.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.93 0.395 . . . . 25.0 110.366 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -79.84 2.88 21.47 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.92 153.18 42.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.698 -0.482 . . . . 25.0 109.698 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 156.01 39.72 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.533 0.938 . . . . 25.0 113.533 -172.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.0 t -99.64 158.91 15.43 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.215 -1.031 . . . . 25.0 108.215 174.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.91 -15.31 10.0 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.161 0.288 . . . . 25.0 111.25 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.6 t -171.89 153.21 3.18 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.939 0.4 . . . . 25.0 111.951 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -125.72 139.66 53.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 104.404 -2.443 . . . . 25.0 104.404 167.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -145.01 151.42 38.54 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.342 -0.984 . . . . 25.0 108.342 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -138.01 135.04 35.55 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.12 161.71 41.42 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 118.35 0.523 . . . . 25.0 109.973 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.34 162.59 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 113.757 1.021 . . . . 25.0 113.757 -167.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -76.74 161.23 28.66 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.648 -1.242 . . . . 25.0 107.648 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.93 157.52 40.16 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.147 -0.933 . . . . 25.0 110.202 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -67.75 -19.7 47.0 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 117.858 -0.961 . . . . 25.0 114.285 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -120.98 31.99 6.16 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 122.819 0.448 . . . . 25.0 111.64 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.512 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.72 163.99 27.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.942 0.877 . . . . 25.0 112.942 -176.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.33 101.02 11.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.433 -1.258 . . . . 25.0 110.348 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -86.5 17.35 3.89 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.828 2.158 . . . . 25.0 116.828 -169.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.8 t -125.4 6.72 7.68 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.689 0.757 . . . . 25.0 109.315 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -107.72 158.45 33.35 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.7 -1.137 . . . . 25.0 108.416 -173.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -66.53 156.12 66.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 O-C-N 121.961 0.453 . . . . 25.0 111.812 178.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -70.33 100.1 1.67 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.123 0.487 . . . . 25.0 112.033 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.6 p -93.51 152.72 18.87 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.648 -1.241 . . . . 25.0 107.648 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -66.14 -25.19 66.86 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.745 -0.597 . . . . 25.0 111.073 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.29 65.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.306 -0.861 . . . . 25.0 112.235 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.5 t -82.02 -5.51 58.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.319 0.489 . . . . 25.0 112.319 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -103.87 154.24 19.84 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 114.673 1.36 . . . . 25.0 114.673 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -94.87 95.65 8.81 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 103.013 -2.958 . . . . 25.0 103.013 163.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.97 -7.03 19.29 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.109 1.152 . . . . 25.0 114.109 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.68 118.75 73.39 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.89 -0.781 . . . . 25.0 108.89 176.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.36 141.31 42.49 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 115.403 -2.598 . . . . 25.0 111.804 179.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -89.98 -12.97 37.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.523 0.564 . . . . 25.0 112.523 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.6 m -149.11 66.11 1.03 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.488 -0.324 . . . . 25.0 111.259 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -88.99 132.52 34.69 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.749 -1.181 . . . . 25.0 109.018 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -123.03 99.19 6.25 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.664 -2.347 . . . . 25.0 104.664 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -90.27 92.06 8.76 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.418 -1.327 . . . . 25.0 107.418 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -104.48 118.17 35.94 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.979 -1.489 . . . . 25.0 106.979 177.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.84 80.53 0.4 Allowed Glycine 0 CA--C 1.503 -0.696 0 CA-C-N 115.396 -0.82 . . . . 25.0 113.48 -170.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.47 15.18 6.03 Favored Glycine 0 C--N 1.322 -0.25 0 C-N-CA 120.916 -0.659 . . . . 25.0 113.661 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.48 104.82 5.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.563 0.697 . . . . 25.0 109.689 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.38 123.23 89.26 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 106.092 -1.818 . . . . 25.0 106.092 176.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.68 161.39 44.06 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 118.352 -0.632 . . . . 25.0 113.739 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.44 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.58 26.61 3.38 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.965 -1.124 . . . . 25.0 107.965 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.13 -15.45 0.41 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.975 1.71 . . . . 25.0 111.947 -174.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.44 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.3 mt-30 -129.43 151.01 50.53 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 103.776 -2.675 . . . . 25.0 103.776 169.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.46 95.0 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 122.382 1.087 . . . . 25.0 108.633 -178.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.8 m -87.36 124.72 33.69 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -118.4 162.44 18.32 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 105.27 -2.122 . . . . 25.0 105.27 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -133.95 146.35 50.4 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 103.81 -2.663 . . . . 25.0 103.81 171.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.22 158.81 27.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.986 -1.116 . . . . 25.0 107.986 -176.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -102.13 117.0 33.86 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.119 0.262 . . . . 25.0 110.67 -177.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.5 mt -75.31 132.13 76.72 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 107.238 -1.393 . . . . 25.0 107.238 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.89 145.93 96.7 Favored 'Trans proline' 0 C--N 1.352 0.742 0 CA-C-O 121.753 0.647 . . . . 25.0 113.492 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.11 -25.83 39.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.093 -0.958 . . . . 25.0 112.48 -168.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -84.01 9.12 13.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.697 -0.683 . . . . 25.0 110.165 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -116.0 51.26 0.97 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.837 0.827 . . . . 25.0 108.966 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.9 p -86.11 165.2 16.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.868 -1.53 . . . . 25.0 106.868 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.29 -169.09 32.83 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 114.541 0.576 . . . . 25.0 114.541 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.0 114.36 22.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.433 0.635 . . . . 25.0 111.116 -168.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.96 170.46 21.3 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.725 -0.671 . . . . 25.0 110.657 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -105.85 150.61 8.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 107.406 -1.331 . . . . 25.0 107.406 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 50.1 mt -131.45 120.21 45.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.214 -2.143 . . . . 25.0 105.214 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.78 130.07 49.64 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.453 -0.794 . . . . 25.0 109.545 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -116.66 129.74 56.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.72 140.18 48.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.154 0.978 . . . . 25.0 112.028 -177.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -114.53 117.36 30.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 106.43 -1.693 . . . . 25.0 106.43 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.08 126.49 42.28 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.5 mm -81.79 141.62 14.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.453 -0.573 . . . . 25.0 109.453 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.58 -42.39 22.37 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.767 0.712 . . . . 25.0 110.394 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.09 -24.08 65.0 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.583 0.957 . . . . 25.0 113.583 -172.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.7 p -139.32 170.54 15.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.966 0.889 . . . . 25.0 110.21 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.22 23.64 0.58 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.125 -0.943 . . . . 25.0 112.21 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -94.32 147.48 23.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.691 -0.631 . . . . 25.0 112.606 -176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.19 143.24 12.08 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.053 -2.203 . . . . 25.0 105.053 172.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -146.66 136.03 22.82 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.997 0.74 . . . . 25.0 112.997 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -93.98 114.8 27.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.524 -0.762 . . . . 25.0 111.54 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . 0.448 ' HB3' ' HG ' ' A' ' 9' ' ' SER . 76.0 mt-30 -97.05 113.37 24.91 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.21 140.71 29.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.043 -0.526 . . . . 25.0 112.051 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.5 tt -125.13 135.47 63.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.787 -1.931 . . . . 25.0 105.787 167.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -95.31 131.2 41.67 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.766 -1.198 . . . . 25.0 107.766 176.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.5 m -132.76 163.23 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 113.103 0.779 . . . . 25.0 113.103 -175.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -119.53 95.04 4.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 104.386 -2.45 . . . . 25.0 104.386 167.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.3 tp -90.03 163.96 14.7 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 112.689 0.625 . . . . 25.0 112.689 -172.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.5 p -144.33 156.74 44.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.153 -1.054 . . . . 25.0 108.153 175.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.379 -0.82 . . . . 25.0 112.416 -175.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.7 m170 . . . . . 0 N--CA 1.484 1.237 0 CA-C-O 121.372 0.606 . . . . 25.0 110.761 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.26 168.76 34.14 Favored Glycine 0 N--CA 1.451 -0.32 1 N-CA-C 100.85 -4.9 . . . . 25.0 100.85 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -146.69 162.64 38.06 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 120.374 2.087 . . . . 25.0 110.507 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -99.34 122.6 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.979 -1.119 . . . . 25.0 107.979 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -73.42 -42.95 61.41 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.801 -1.09 . . . . 25.0 109.593 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -152.62 129.56 5.61 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 106.129 -1.804 . . . . 25.0 106.129 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.67 133.37 16.49 Favored 'Cis proline' 0 CA--C 1.534 0.495 0 C-N-CA 128.577 0.657 . . . . 25.0 111.476 -0.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.52 110.72 3.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 25.0 112.409 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 156.81 38.74 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.275 -0.639 . . . . 25.0 109.275 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -56.3 -24.77 45.54 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.642 0.777 . . . . 25.0 112.656 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.99 -49.89 58.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.771 0.796 . . . . 25.0 109.066 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -66.22 -37.43 85.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.468 -0.787 . . . . 25.0 109.888 177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -63.17 -33.1 74.73 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 122.258 -0.276 . . . . 25.0 110.808 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -39.07 91.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 25.0 110.235 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 tmtm? -67.67 -35.92 79.76 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.565 -0.531 . . . . 25.0 109.565 177.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.9 mt -77.37 4.09 11.65 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.21 -0.45 . . . . 25.0 111.599 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 58.19 22.44 9.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.306 1.443 . . . . 25.0 113.265 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.446 ' C ' HD21 ' A' ' 19' ' ' ASN . 93.1 mt -85.03 -21.09 29.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.242 -1.392 . . . . 25.0 107.242 173.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.446 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.04 158.16 32.81 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.2 p -136.77 175.34 9.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.112 -0.329 . . . . 25.0 110.112 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 72.11 4.91 5.17 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.423 1.638 . . . . 25.0 115.423 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -66.63 -38.26 86.55 Favored 'General case' 0 CA--C 1.501 -0.918 0 O-C-N 121.823 -0.548 . . . . 25.0 110.972 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -63.49 1.42 Allowed Glycine 0 C--O 1.218 -0.854 0 O-C-N 123.753 0.658 . . . . 25.0 112.271 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.9 t -87.81 -54.35 4.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.571 1.177 . . . . 25.0 111.37 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -68.83 -7.01 6.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.236 -1.347 . . . . 25.0 113.82 -171.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -91.51 0.3 57.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.848 -0.533 . . . . 25.0 111.261 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -116.02 -34.08 4.85 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.904 -0.719 . . . . 25.0 109.893 173.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -126.91 101.75 25.83 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 109.284 -0.636 . . . . 25.0 109.284 169.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.24 -20.4 21.37 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 117.108 -1.461 . . . . 25.0 114.53 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -86.17 11.87 10.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.338 0.495 . . . . 25.0 112.338 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.1 m -65.18 -12.42 50.96 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.1 130.24 28.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 122.135 0.969 . . . . 25.0 112.919 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -152.96 151.07 29.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 104.975 -2.232 . . . . 25.0 104.975 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.65 -169.38 22.89 Favored Glycine 0 C--O 1.229 -0.216 0 N-CA-C 109.755 -1.338 . . . . 25.0 109.755 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.42 147.83 49.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 118.051 0.926 . . . . 25.0 111.725 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -65.99 157.04 31.87 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.883 -1.154 . . . . 25.0 107.883 172.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.58 -4.01 1.66 Allowed Glycine 0 C--N 1.317 -0.494 0 CA-C-N 114.773 -1.103 . . . . 25.0 112.91 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -75.76 144.58 76.9 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 121.689 -0.889 . . . . 25.0 109.116 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -91.54 -17.86 14.83 Favored 'Cis proline' 0 CA--C 1.543 0.962 0 N-CA-C 116.041 1.516 . . . . 25.0 116.041 -5.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.6 -37.44 62.88 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.913 1.449 . . . . 25.0 114.913 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -116.47 32.29 6.22 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.212 -1.773 . . . . 25.0 106.212 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.59 -176.94 47.0 Favored Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 114.591 -1.186 . . . . 25.0 110.744 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.95 171.54 3.68 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.982 2.455 . . . . 25.0 113.095 177.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.11 160.07 30.9 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.726 -1.213 . . . . 25.0 107.726 174.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.75 139.62 57.14 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 106.038 -1.838 . . . . 25.0 106.038 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.4 -8.02 76.33 Favored Glycine 0 C--O 1.229 -0.163 0 CA-C-N 116.403 -0.362 . . . . 25.0 112.666 -173.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -126.18 9.5 7.37 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.396 -0.473 . . . . 25.0 111.329 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.86 -49.53 83.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 122.151 -0.343 . . . . 25.0 111.166 -174.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -20.9 57.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.98 0.419 . . . . 25.0 110.266 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -84.73 -8.57 58.79 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.995 0.739 . . . . 25.0 112.995 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 33.31 13.65 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.53 0.732 . . . . 25.0 110.043 -172.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.47 39.24 25.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.816 1.414 . . . . 25.0 114.816 -177.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -120.55 137.55 54.33 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.105 0.562 . . . . 25.0 110.714 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.0 p -62.95 -36.28 82.95 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 115.617 1.71 . . . . 25.0 115.617 -173.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 t -72.29 -5.01 33.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -177.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -121.14 12.5 11.08 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -72.23 -36.5 69.12 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.051 -1.031 . . . . 25.0 110.106 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -71.69 -11.07 60.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.496 -0.774 . . . . 25.0 109.715 175.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 mp -93.95 -1.3 54.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.822 -0.807 . . . . 25.0 108.822 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -116.26 -32.02 5.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.567 0.58 . . . . 25.0 112.567 174.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -92.22 131.77 37.19 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 107.453 -1.314 . . . . 25.0 107.453 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.476 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.3 pm0 -137.56 160.61 38.69 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.405 -0.816 . . . . 25.0 111.443 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 52.8 p -119.99 159.57 46.42 Favored Pre-proline 0 C--O 1.242 0.667 1 N-CA-C 100.068 -4.049 . . . . 25.0 100.068 159.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -70.32 -6.37 18.72 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 116.281 -2.012 . . . . 25.0 115.558 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.2 t -114.5 2.1 14.51 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.636 0.606 . . . . 25.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -78.33 -28.13 47.26 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.088 0.773 . . . . 25.0 113.088 -175.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.476 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.5 m95 -124.5 163.13 22.5 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 120.581 0.229 . . . . 25.0 110.608 -177.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.31 129.49 40.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 106.158 -1.793 . . . . 25.0 106.158 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -101.86 107.56 18.78 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 100.231 -3.989 . . . . 25.0 100.231 177.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -68.37 134.48 50.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.242 -0.89 . . . . 25.0 110.141 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -92.63 100.78 13.23 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 25.0 108.0 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.5 mt -131.17 173.99 10.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.106 -1.072 . . . . 25.0 108.106 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.23 154.33 25.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 111.519 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 58.9 p -77.04 168.37 20.2 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 173.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 96.61 -161.86 22.2 Favored Glycine 0 C--O 1.241 0.564 0 N-CA-C 110.366 -1.094 . . . . 25.0 110.366 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.95 132.29 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 CA-C-N 119.057 1.429 . . . . 25.0 113.482 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.94 160.76 38.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.473 -1.677 . . . . 25.0 106.473 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 p -101.37 151.1 22.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.686 -1.227 . . . . 25.0 107.686 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -138.02 100.97 4.3 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.074 -2.195 . . . . 25.0 105.074 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.07 114.33 28.15 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.356 -0.838 . . . . 25.0 110.038 -176.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -101.5 150.96 22.53 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.526 -0.761 . . . . 25.0 110.631 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -126.63 116.46 21.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 104.092 -2.559 . . . . 25.0 104.092 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.76 126.64 55.64 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.547 -0.751 . . . . 25.0 110.952 -174.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.3 t -89.01 13.9 11.85 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.44 0.638 . . . . 25.0 110.565 176.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -133.68 138.75 46.03 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.94 -0.475 . . . . 25.0 109.855 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -86.09 -7.67 58.43 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.681 0.623 . . . . 25.0 112.681 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.77 157.92 31.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.4 t -76.98 156.0 32.22 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 114.809 1.411 . . . . 25.0 114.809 -172.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -97.14 159.41 14.93 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 172.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -117.81 -14.54 10.11 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 123.127 0.267 . . . . 25.0 111.263 171.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -172.19 152.85 2.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.947 0.403 . . . . 25.0 111.335 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -125.43 136.91 53.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 167.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -142.04 150.19 40.94 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.044 -1.095 . . . . 25.0 108.044 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -136.57 133.6 36.56 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.03 164.14 35.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.334 0.515 . . . . 25.0 110.595 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.91 164.81 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.331 0.863 . . . . 25.0 113.331 -166.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.6 p -81.33 162.92 23.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.286 -1.375 . . . . 25.0 107.286 168.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -61.27 157.71 42.21 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.468 -0.787 . . . . 25.0 108.996 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -69.0 -22.33 35.75 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 116.464 -1.891 . . . . 25.0 114.021 -173.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -114.05 31.9 6.24 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.322 0.49 . . . . 25.0 112.322 -173.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.501 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.5 p-90 -80.42 163.31 23.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.527 0.68 . . . . 25.0 110.106 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -87.28 101.08 13.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.309 -0.86 . . . . 25.0 110.324 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.501 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.19 22.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 115.253 1.575 . . . . 25.0 115.253 -174.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.1 t -118.93 1.09 11.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.565 0.697 . . . . 25.0 109.852 175.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -112.51 160.0 32.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 107.937 -1.135 . . . . 25.0 107.937 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.36 159.48 43.67 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 120.431 0.754 . . . . 25.0 112.592 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.4 mp -68.12 117.12 9.54 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 122.189 -0.32 . . . . 25.0 110.293 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.5 p -114.41 150.59 34.45 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.578 -0.897 . . . . 25.0 108.578 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.8 ptp180 -64.57 -24.9 67.75 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.977 -0.452 . . . . 25.0 111.621 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.54 72.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.699 -0.682 . . . . 25.0 111.999 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 85.0 p -88.98 -3.01 58.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.111 -0.495 . . . . 25.0 111.978 -178.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -97.28 150.81 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.941 1.46 . . . . 25.0 114.941 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.23 96.15 8.22 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 102.883 -3.006 . . . . 25.0 102.883 162.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.26 0.63 7.52 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.142 1.164 . . . . 25.0 114.142 -171.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 10.2 t -98.19 134.46 22.01 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.197 -0.668 . . . . 25.0 109.197 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 146.81 37.99 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 116.447 -1.902 . . . . 25.0 112.29 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -97.1 -6.63 34.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.995 0.426 . . . . 25.0 111.335 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 36.0 m -151.71 71.61 0.99 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -88.88 131.35 35.15 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 119.172 -1.011 . . . . 25.0 109.628 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -122.03 99.06 6.23 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 103.465 -2.791 . . . . 25.0 103.465 176.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -92.8 91.95 7.71 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.433 -1.321 . . . . 25.0 107.433 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -113.74 118.56 34.66 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.81 81.8 0.36 Allowed Glycine 0 CA--C 1.501 -0.841 0 CA-C-N 115.551 -0.749 . . . . 25.0 112.901 -170.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.47 16.06 5.24 Favored Glycine 0 C--N 1.32 -0.342 0 C-N-CA 120.931 -0.652 . . . . 25.0 113.699 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.88 104.03 4.61 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.579 0.704 . . . . 25.0 109.449 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.7 126.23 90.82 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 106.376 -1.712 . . . . 25.0 106.376 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.09 171.13 18.91 Favored 'Trans proline' 0 C--N 1.344 0.294 0 N-CA-C 113.573 0.566 . . . . 25.0 113.573 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.55 29.84 5.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.687 -1.227 . . . . 25.0 107.687 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.08 -15.04 0.35 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.894 1.678 . . . . 25.0 111.868 -173.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.464 ' H ' ' C ' ' A' ' 128' ' ' ALA . 68.4 mt-30 -129.0 154.69 46.37 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 103.416 -2.809 . . . . 25.0 103.416 170.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.4 t -140.48 94.98 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.577 0 N-CA-C 106.266 -1.753 . . . . 25.0 106.266 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.14 145.57 27.56 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 104.43 -2.433 . . . . 25.0 104.43 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.04 166.98 31.8 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.493 -1.685 . . . . 25.0 108.217 -178.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -136.14 154.3 51.02 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.95 160.55 30.92 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.769 -1.567 . . . . 25.0 106.769 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -103.38 115.55 30.76 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.018 0.199 . . . . 25.0 111.004 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.71 130.33 73.89 Favored Pre-proline 0 C--O 1.239 0.519 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.69 147.22 95.02 Favored 'Trans proline' 0 C--N 1.351 0.683 0 CA-C-O 121.729 0.637 . . . . 25.0 113.232 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.22 38.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.188 -0.915 . . . . 25.0 112.554 -169.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.4 p-10 -85.02 9.57 14.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.65 -0.705 . . . . 25.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -113.51 56.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.864 -1.161 . . . . 25.0 107.864 170.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.2 p -86.18 170.79 11.83 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 106.968 -1.493 . . . . 25.0 106.968 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 82.25 -165.42 44.94 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 116.926 1.53 . . . . 25.0 116.926 174.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.4 t -86.04 106.47 17.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.295 0.569 . . . . 25.0 110.962 -168.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.471 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.6 p-80 -157.96 172.43 18.46 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.082 -0.508 . . . . 25.0 111.306 -176.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.8 p -102.87 150.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.786 -1.19 . . . . 25.0 107.786 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.9 mt -134.84 129.6 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 N-CA-C 101.487 -3.523 . . . . 25.0 101.487 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -120.28 139.71 52.31 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 109.78 -0.452 . . . . 25.0 109.78 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -120.6 134.26 55.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.073 -0.714 . . . . 25.0 109.073 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.25 139.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 122.165 0.983 . . . . 25.0 112.02 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -109.45 113.2 25.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.299 -1.741 . . . . 25.0 106.299 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 122.22 35.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.735 -1.209 . . . . 25.0 107.735 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.8 mm -78.52 142.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.388 -0.597 . . . . 25.0 109.388 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.23 -43.19 24.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.819 0.736 . . . . 25.0 110.224 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.01 -23.47 65.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.755 -1.111 . . . . 25.0 113.898 -172.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.0 p -139.82 170.4 15.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.045 0.926 . . . . 25.0 110.299 -175.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.6 20.04 0.96 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.115 -0.948 . . . . 25.0 112.232 177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.13 146.07 24.57 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.617 -0.677 . . . . 25.0 112.491 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.41 143.46 11.87 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.385 -2.08 . . . . 25.0 105.385 172.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -146.6 130.9 17.53 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 111.772 0.286 . . . . 25.0 111.772 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -88.95 115.76 26.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.868 -0.605 . . . . 25.0 110.663 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.02 20.67 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.691 -0.855 . . . . 25.0 108.691 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.68 143.43 33.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 25.0 112.552 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -129.0 134.94 63.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 105.135 -2.172 . . . . 25.0 105.135 166.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -94.45 130.93 40.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.84 162.26 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 112.973 0.731 . . . . 25.0 112.973 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -120.38 95.12 4.6 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.362 -2.459 . . . . 25.0 104.362 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.9 tp -90.5 162.81 14.88 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 113.274 0.842 . . . . 25.0 113.274 -171.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.3 p -145.26 164.42 31.46 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.72 0 CA-C-O 117.966 -1.016 . . . . 25.0 110.785 -178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.2 m80 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.328 0.585 . . . . 25.0 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.59 169.79 38.38 Favored Glycine 0 CA--C 1.508 -0.357 1 N-CA-C 102.54 -4.224 . . . . 25.0 102.54 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 p90 -144.16 160.01 41.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 119.954 1.877 . . . . 25.0 110.461 178.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.24 121.14 47.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.48 -40.94 56.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.515 -1.22 . . . . 25.0 109.972 -174.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.6 t -153.7 128.68 4.88 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 105.77 -1.937 . . . . 25.0 105.77 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.19 130.6 11.28 Favored 'Cis proline' 0 C--N 1.348 0.512 0 C-N-CA 128.554 0.648 . . . . 25.0 111.099 -0.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 114.48 5.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.106 -0.497 . . . . 25.0 112.263 -172.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.1 t -71.86 158.64 35.69 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 108.628 -0.878 . . . . 25.0 108.628 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -54.6 -26.33 31.93 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.578 0.751 . . . . 25.0 111.81 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.97 -53.45 38.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.678 0.752 . . . . 25.0 109.327 175.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.09 -34.86 78.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.733 -0.667 . . . . 25.0 110.558 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -63.45 -33.14 74.9 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 122.174 -0.329 . . . . 25.0 110.548 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -40.03 95.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.319 0.581 . . . . 25.0 109.617 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 tmtm? -68.3 -33.85 75.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.081 -0.509 . . . . 25.0 110.395 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.91 5.21 14.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.454 176.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 58.83 23.23 11.05 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.098 1.359 . . . . 25.0 113.053 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.468 ' C ' HD21 ' A' ' 19' ' ' ASN . 90.4 mt -88.44 -21.24 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.818 -1.178 . . . . 25.0 107.818 174.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.468 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.31 160.17 28.65 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.687 -2.338 . . . . 25.0 104.687 176.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -136.42 174.8 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.247 -0.279 . . . . 25.0 110.247 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 71.8 5.26 5.31 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.917 1.821 . . . . 25.0 115.917 173.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.3 m -67.35 -35.2 78.89 Favored 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 121.555 -0.716 . . . . 25.0 111.045 174.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.4 -64.3 1.38 Allowed Glycine 0 C--O 1.217 -0.918 0 O-C-N 123.818 0.699 . . . . 25.0 112.185 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 t -87.89 -54.09 4.42 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.621 1.2 . . . . 25.0 111.176 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.73 -8.27 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.151 -1.386 . . . . 25.0 113.164 -171.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.81 1.75 54.73 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.976 -0.453 . . . . 25.0 111.505 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.51 -34.88 3.68 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.713 -0.795 . . . . 25.0 110.427 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -127.12 100.57 26.77 Favored Pre-proline 0 C--O 1.241 0.636 0 C-N-CA 122.132 0.173 . . . . 25.0 111.163 169.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.05 -21.28 18.36 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 117.141 -1.439 . . . . 25.0 114.505 -176.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -83.83 11.98 6.75 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.697 0.629 . . . . 25.0 112.697 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -68.99 -16.22 63.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.739 0.304 . . . . 25.0 111.77 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.68 137.69 24.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 113.983 1.105 . . . . 25.0 113.983 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -152.97 152.99 32.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 106.156 -1.794 . . . . 25.0 106.156 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -155.34 -168.31 18.27 Favored Glycine 0 C--O 1.229 -0.206 0 N-CA-C 108.694 -1.763 . . . . 25.0 108.694 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.6 tp -127.8 147.31 50.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 118.325 1.063 . . . . 25.0 111.704 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -66.47 156.89 33.52 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 172.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 1.84 3.84 Favored Glycine 0 C--O 1.225 -0.43 0 CA-C-N 114.962 -1.017 . . . . 25.0 113.255 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.95 145.1 77.05 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 121.732 -0.864 . . . . 25.0 109.691 -176.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -91.63 -16.07 18.36 Favored 'Cis proline' 0 CA--C 1.54 0.823 0 N-CA-C 115.119 1.161 . . . . 25.0 115.119 -6.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -71.8 -35.68 70.06 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.711 1.374 . . . . 25.0 114.711 -169.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.43 30.97 6.99 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.508 -2.034 . . . . 25.0 105.508 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.31 -173.43 40.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 114.259 -1.337 . . . . 25.0 111.131 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.11 171.61 4.91 Favored 'Trans proline' 0 C--O 1.242 0.685 0 C-N-CA 123.099 2.532 . . . . 25.0 113.713 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.01 159.94 31.15 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.649 -1.612 . . . . 25.0 106.649 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.42 138.81 58.27 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.385 -1.28 . . . . 25.0 107.864 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.83 -4.32 82.89 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-O 121.408 0.449 . . . . 25.0 112.794 -174.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.4 m170 -124.19 10.23 8.69 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.171 -0.678 . . . . 25.0 109.171 177.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.0 mt -65.32 -50.16 74.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 122.361 -0.212 . . . . 25.0 111.509 -173.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.64 -20.35 58.56 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.811 -0.556 . . . . 25.0 110.124 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.0 p -83.54 -8.27 59.37 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.434 0.531 . . . . 25.0 112.434 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.42 34.02 14.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.627 0.771 . . . . 25.0 110.168 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.4 OUTLIER 58.07 39.74 25.96 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.734 1.383 . . . . 25.0 114.734 -177.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -120.74 134.4 55.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.174 0.59 . . . . 25.0 110.752 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -62.38 -34.34 76.51 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.698 1.37 . . . . 25.0 114.698 -175.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 t -70.49 -8.33 50.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.488 0.551 . . . . 25.0 112.488 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -120.84 13.76 11.53 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.479 -1.304 . . . . 25.0 107.479 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -72.4 -37.18 68.75 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.056 -1.028 . . . . 25.0 110.455 -176.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -71.45 -13.7 61.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.721 0.772 . . . . 25.0 109.084 174.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mp -90.17 -3.78 57.66 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.673 -0.694 . . . . 25.0 109.142 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -113.95 -34.21 5.5 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -92.82 119.91 32.64 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 121.596 -0.69 . . . . 25.0 110.312 -178.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.485 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.14 160.96 25.38 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.213 -0.903 . . . . 25.0 108.888 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.8 p -117.77 162.67 27.88 Favored Pre-proline 0 C--N 1.316 -0.857 1 N-CA-C 99.671 -4.196 . . . . 25.0 99.671 162.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.84 -4.91 14.29 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 116.782 -1.679 . . . . 25.0 115.687 -175.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -125.54 11.53 7.97 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.228 0.537 . . . . 25.0 111.783 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -77.46 -28.21 52.33 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.868 0.692 . . . . 25.0 112.868 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.485 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.5 m95 -125.88 165.41 18.78 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 110.145 -0.317 . . . . 25.0 110.145 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -66.87 126.54 29.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.23 -2.137 . . . . 25.0 105.23 168.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -94.86 104.89 16.79 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 100.294 -3.965 . . . . 25.0 100.294 177.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.79 134.87 54.03 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.654 -1.157 . . . . 25.0 110.098 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -93.26 99.37 11.93 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.585 -1.265 . . . . 25.0 107.585 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.9 mt -129.68 173.83 10.26 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.669 -1.975 . . . . 25.0 105.669 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -116.73 163.35 16.27 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -178.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -77.48 172.88 12.65 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.653 -1.612 . . . . 25.0 107.086 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.54 -162.62 31.94 Favored Glycine 0 C--O 1.24 0.479 0 N-CA-C 111.125 -0.79 . . . . 25.0 111.125 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.13 130.25 35.44 Favored 'Trans proline' 0 C--N 1.346 0.418 0 CA-C-N 118.8 1.3 . . . . 25.0 113.667 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -137.52 158.59 44.06 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.51 -1.663 . . . . 25.0 106.51 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 p -96.22 150.31 20.68 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -135.3 100.94 4.67 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 104.512 -2.403 . . . . 25.0 104.512 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.72 114.64 28.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.911 0.862 . . . . 25.0 109.521 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -100.08 146.99 26.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.3 -0.864 . . . . 25.0 109.492 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.31 114.39 18.19 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 103.624 -2.732 . . . . 25.0 103.624 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.8 mp -111.93 133.15 54.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.596 -0.729 . . . . 25.0 110.83 -172.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -99.19 17.85 18.92 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.763 0.792 . . . . 25.0 109.049 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.58 133.74 50.99 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.201 -0.666 . . . . 25.0 109.201 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -87.27 -17.21 33.06 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.535 0.939 . . . . 25.0 113.535 -177.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -73.1 162.05 29.91 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.956 0.724 . . . . 25.0 112.956 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -66.41 155.93 36.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 116.508 2.04 . . . . 25.0 116.508 -170.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.432 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 8.2 t -101.37 158.98 15.66 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.694 -1.225 . . . . 25.0 107.694 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -117.94 -17.22 9.79 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.302 0.482 . . . . 25.0 112.302 172.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.9 t -171.09 154.38 4.06 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.503 0.556 . . . . 25.0 112.503 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.8 m95 -128.8 140.71 51.58 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 104.64 -2.355 . . . . 25.0 104.64 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.6 mtt-85 -147.43 151.7 36.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.39 -0.967 . . . . 25.0 108.39 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -137.93 138.72 39.27 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.114 -1.439 . . . . 25.0 107.114 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.66 162.77 39.56 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.284 0.493 . . . . 25.0 109.92 176.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.99 164.96 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 114.275 1.213 . . . . 25.0 114.275 -167.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 11.0 p -79.6 161.65 25.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.226 -1.027 . . . . 25.0 108.226 169.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.65 157.47 47.7 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.116 -0.947 . . . . 25.0 109.621 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.77 -18.44 36.96 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 117.444 -1.237 . . . . 25.0 114.072 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.73 31.93 6.21 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 122.791 0.436 . . . . 25.0 111.566 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -74.25 162.88 28.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.847 0.832 . . . . 25.0 111.434 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -83.64 101.06 11.24 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.736 -1.12 . . . . 25.0 110.172 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -84.81 14.09 5.16 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 116.597 2.073 . . . . 25.0 116.597 -171.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -117.93 1.91 12.1 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.833 -0.802 . . . . 25.0 108.833 175.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -105.09 158.48 32.0 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 107.832 -1.173 . . . . 25.0 107.832 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -66.65 159.44 51.0 Favored 'Trans proline' 0 C--N 1.344 0.327 0 O-C-N 122.024 0.486 . . . . 25.0 112.232 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.96 101.9 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 25.0 110.641 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.6 p -98.63 159.76 14.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.449 -0.945 . . . . 25.0 108.449 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -65.42 -25.76 67.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.097 0.475 . . . . 25.0 110.964 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -24.97 61.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.648 -0.706 . . . . 25.0 112.277 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.7 m -79.29 -12.1 59.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.754 0.311 . . . . 25.0 111.82 -178.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.42 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 42.2 m-85 -99.17 155.04 17.68 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.16 1.541 . . . . 25.0 115.16 -174.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -94.43 95.63 8.98 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 102.619 -3.104 . . . . 25.0 102.619 163.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.9 mt -69.79 20.89 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 116.428 2.011 . . . . 25.0 116.428 -169.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.0 t -114.3 137.39 22.52 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.272 -0.64 . . . . 25.0 109.272 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.77 152.07 46.91 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.208 -2.728 . . . . 25.0 111.196 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -107.9 -6.69 16.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.972 0.415 . . . . 25.0 111.688 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.5 m -152.6 70.06 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.133 -0.485 . . . . 25.0 109.911 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -89.06 135.06 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.239 -0.984 . . . . 25.0 109.172 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.01 99.12 5.98 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.765 -2.309 . . . . 25.0 104.765 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -93.24 92.06 7.55 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.931 -0.766 . . . . 25.0 108.931 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -107.42 117.06 33.1 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.671 -1.233 . . . . 25.0 107.671 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.55 80.58 0.37 Allowed Glycine 0 CA--C 1.503 -0.703 0 CA-C-N 115.799 -0.637 . . . . 25.0 113.519 -170.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.43 15.87 5.8 Favored Glycine 0 C--N 1.322 -0.237 0 C-N-CA 120.96 -0.638 . . . . 25.0 113.264 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.48 105.59 4.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.358 0.599 . . . . 25.0 109.585 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 88.8 mt -72.29 122.59 87.83 Favored Pre-proline 0 C--N 1.321 -0.673 0 N-CA-C 105.384 -2.08 . . . . 25.0 105.384 175.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.94 167.24 26.55 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 117.864 -0.957 . . . . 25.0 113.826 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.442 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -96.32 25.8 4.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.291 -1.003 . . . . 25.0 108.291 175.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.65 -12.36 0.46 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.822 1.649 . . . . 25.0 112.168 -174.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' A' ' 128' ' ' ALA . 63.7 mt-30 -130.12 152.2 49.83 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.046 -2.576 . . . . 25.0 104.046 169.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.1 t -142.94 95.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.843 -1.54 . . . . 25.0 106.843 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -86.94 141.09 28.97 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.199 -2.148 . . . . 25.0 105.199 174.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.52 167.0 26.53 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.513 -2.032 . . . . 25.0 105.513 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -134.08 152.02 51.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.04 -2.208 . . . . 25.0 105.04 172.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.3 160.33 35.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.441 -1.318 . . . . 25.0 107.441 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -103.43 116.0 31.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.597 -0.274 . . . . 25.0 111.018 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 131.24 72.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -60.91 144.21 99.52 Favored 'Trans proline' 0 C--N 1.352 0.726 0 N-CA-C 113.919 0.7 . . . . 25.0 113.919 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.23 -28.2 42.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.182 -0.917 . . . . 25.0 112.514 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -82.35 10.25 7.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.733 0.778 . . . . 25.0 110.133 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -117.78 53.43 0.94 Allowed 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.553 -1.277 . . . . 25.0 107.553 171.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.95 11.82 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 106.398 -1.704 . . . . 25.0 106.398 174.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.95 -165.15 41.47 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 116.262 1.265 . . . . 25.0 116.262 176.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -86.02 108.61 18.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.446 0.641 . . . . 25.0 111.012 -168.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -159.39 172.36 18.07 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.784 -0.644 . . . . 25.0 110.921 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -109.06 152.04 11.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.219 -1.03 . . . . 25.0 108.219 -179.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 67.8 mt -134.44 123.22 42.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 104.229 -2.508 . . . . 25.0 104.229 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.54 127.7 52.33 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 122.899 0.479 . . . . 25.0 110.261 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -111.54 129.36 56.08 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 108.816 -0.809 . . . . 25.0 108.816 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.7 p -126.72 139.75 50.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 122.172 0.987 . . . . 25.0 111.92 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.432 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 9.7 t90 -117.13 124.12 48.4 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.56 126.52 49.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.597 -0.52 . . . . 25.0 109.597 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 35.9 mm -77.85 142.47 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.93 -45.55 20.25 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.929 0.786 . . . . 25.0 110.678 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.17 -21.25 64.9 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.575 1.324 . . . . 25.0 114.575 -172.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 50.0 p -138.59 169.09 18.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.915 0.864 . . . . 25.0 109.577 -175.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.7 19.67 0.81 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.257 -0.883 . . . . 25.0 112.244 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.1 142.65 27.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -176.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.46 141.1 14.46 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 171.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -140.81 135.41 31.4 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.501 0.556 . . . . 25.0 112.501 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -93.65 112.47 24.35 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.449 -0.796 . . . . 25.0 111.149 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -97.15 108.21 20.89 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.971 -0.752 . . . . 25.0 108.971 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.11 141.75 33.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.744 -0.662 . . . . 25.0 111.737 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -125.27 132.88 70.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 105.553 -2.017 . . . . 25.0 105.553 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -96.46 129.42 43.83 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.3 162.31 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.666 0.987 . . . . 25.0 113.666 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.49 94.93 4.73 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.652 -2.721 . . . . 25.0 103.652 164.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.9 tp -91.29 156.86 17.49 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 112.844 0.683 . . . . 25.0 112.844 -170.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.4 p -145.76 168.06 21.65 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.998 -0.439 . . . . 25.0 110.886 175.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.767 0 CA-C-O 118.711 -0.661 . . . . 25.0 110.602 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 121.012 0.434 . . . . 25.0 110.548 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.92 169.4 33.9 Favored Glycine 0 CA--C 1.509 -0.327 1 N-CA-C 101.872 -4.491 . . . . 25.0 101.872 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -145.75 161.49 39.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 120.188 1.994 . . . . 25.0 110.278 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -97.99 122.96 50.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.809 -1.182 . . . . 25.0 107.809 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -73.19 -43.34 61.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.999 -1.001 . . . . 25.0 109.424 -176.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.7 t -153.29 131.36 6.33 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.16 -1.793 . . . . 25.0 106.16 177.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.96 134.18 19.1 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.498 0.624 . . . . 25.0 111.395 -0.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.26 109.83 2.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.001 -0.545 . . . . 25.0 112.239 -172.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.6 t -71.94 157.55 37.63 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.947 -0.76 . . . . 25.0 108.947 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -55.86 -24.36 36.34 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.439 0.695 . . . . 25.0 111.812 178.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.54 -53.28 36.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.711 0.767 . . . . 25.0 109.279 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.01 -37.18 85.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.489 -0.778 . . . . 25.0 110.277 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -62.97 -32.82 74.23 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 120.991 -0.284 . . . . 25.0 110.814 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.05 94.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.086 0.47 . . . . 25.0 110.53 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.439 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.0 tmtm? -70.07 -33.42 71.9 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.05 0.452 . . . . 25.0 110.047 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.65 3.62 11.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.481 174.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.03 10.09 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.39 1.476 . . . . 25.0 113.05 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.8 mt -85.86 -22.28 27.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.196 -1.409 . . . . 25.0 107.196 173.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.425 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.5 m120 -123.3 158.78 30.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 105.004 -2.221 . . . . 25.0 105.004 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.6 p -135.95 177.76 7.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.463 -0.569 . . . . 25.0 109.463 -176.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 72.02 4.97 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.498 1.666 . . . . 25.0 115.498 173.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.4 m -69.95 -37.15 75.76 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.484 -0.76 . . . . 25.0 111.647 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.22 -63.5 1.72 Allowed Glycine 0 C--O 1.219 -0.838 0 O-C-N 123.474 0.484 . . . . 25.0 112.192 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.0 t -88.04 -53.33 4.78 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.392 1.092 . . . . 25.0 111.544 -178.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -10.56 13.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.447 -1.251 . . . . 25.0 113.054 -171.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -87.71 2.28 51.54 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.902 -0.499 . . . . 25.0 112.101 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -120.07 -34.74 3.62 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.756 -0.778 . . . . 25.0 110.677 172.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.05 105.32 22.32 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.288 -0.634 . . . . 25.0 109.288 169.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.439 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 86.9 Cg_endo -76.1 -20.23 14.93 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 116.326 -1.983 . . . . 25.0 114.16 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -85.0 12.11 8.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.555 0.576 . . . . 25.0 112.555 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -68.79 -12.13 61.15 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.859 0.361 . . . . 25.0 111.966 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.09 133.65 29.52 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.877 0.846 . . . . 25.0 112.734 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -152.85 153.93 34.08 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.882 -1.525 . . . . 25.0 106.882 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.53 -172.43 26.69 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 109.339 -1.504 . . . . 25.0 109.339 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.4 tp -124.28 151.49 44.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.848 0.824 . . . . 25.0 111.774 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -64.26 156.99 27.15 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.772 -1.196 . . . . 25.0 107.772 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.17 -2.68 3.25 Favored Glycine 0 C--O 1.223 -0.565 0 CA-C-N 114.517 -1.22 . . . . 25.0 113.028 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -75.76 138.89 69.89 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 121.407 -1.054 . . . . 25.0 110.522 -175.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -92.71 -15.76 16.73 Favored 'Cis proline' 0 CA--C 1.543 0.955 0 N-CA-C 115.609 1.35 . . . . 25.0 115.609 -6.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -71.05 -35.35 71.92 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.412 1.634 . . . . 25.0 115.412 -168.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.07 32.74 5.71 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.938 -1.875 . . . . 25.0 105.938 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.21 -174.28 40.57 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 114.407 -1.27 . . . . 25.0 111.496 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.98 170.87 4.28 Favored 'Trans proline' 0 C--O 1.241 0.637 0 C-N-CA 123.212 2.608 . . . . 25.0 113.359 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.13 159.96 31.03 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.2 -1.407 . . . . 25.0 107.2 174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.86 139.19 58.04 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.424 -1.262 . . . . 25.0 107.96 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.39 -5.66 76.34 Favored Glycine 0 C--O 1.23 -0.12 0 CA-C-O 121.704 0.613 . . . . 25.0 112.874 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 20.3 m170 -126.43 9.21 7.18 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 71.4 mt -65.96 -49.7 74.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.276 -0.265 . . . . 25.0 111.161 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.17 -21.26 58.89 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.842 -0.536 . . . . 25.0 109.774 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -83.4 -6.58 59.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.758 0.651 . . . . 25.0 112.758 -178.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.78 32.6 12.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.544 0.738 . . . . 25.0 110.209 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.45 35.78 22.97 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.636 1.347 . . . . 25.0 114.636 -177.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -120.56 141.19 50.51 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.999 0.52 . . . . 25.0 111.743 176.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -65.35 -35.27 80.47 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.0 -6.85 45.13 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.348 0.594 . . . . 25.0 112.353 -177.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -120.45 12.66 11.66 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 107.226 -1.398 . . . . 25.0 107.226 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -71.77 -36.02 70.23 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.893 -1.129 . . . . 25.0 110.112 -175.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -71.38 -14.47 62.18 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.834 0.826 . . . . 25.0 109.967 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.9 mp -87.48 -7.59 57.44 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.405 -0.961 . . . . 25.0 108.405 -178.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -112.35 -31.99 6.65 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 120.959 0.409 . . . . 25.0 112.006 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -94.94 122.1 37.23 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 121.66 -0.65 . . . . 25.0 109.898 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.446 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -130.0 160.97 32.02 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.423 -0.955 . . . . 25.0 108.423 177.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.4 p -117.05 163.6 22.32 Favored Pre-proline 0 C--N 1.32 -0.71 1 N-CA-C 99.778 -4.156 . . . . 25.0 99.778 162.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -2.29 9.46 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 116.473 -1.885 . . . . 25.0 115.936 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.4 t -128.03 11.1 6.5 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.512 0.673 . . . . 25.0 111.831 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -79.12 -29.19 43.05 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.179 -0.951 . . . . 25.0 113.549 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.446 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.2 m95 -125.71 166.88 15.97 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.957 -0.386 . . . . 25.0 109.957 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -66.55 118.58 10.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.842 -1.54 . . . . 25.0 106.842 172.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -92.4 103.65 16.06 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 100.624 -3.843 . . . . 25.0 100.624 176.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.18 135.03 53.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.8 -1.091 . . . . 25.0 110.195 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -92.88 99.96 12.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.562 -1.199 . . . . 25.0 107.799 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.8 mt -131.7 173.95 10.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.558 -1.645 . . . . 25.0 106.558 -175.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -114.79 163.22 15.81 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.929 1.085 . . . . 25.0 113.929 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.5 p -76.96 168.58 19.86 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.71 -161.14 24.7 Favored Glycine 0 C--O 1.24 0.514 0 N-CA-C 110.619 -0.993 . . . . 25.0 110.619 -178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.85 131.11 41.87 Favored 'Trans proline' 0 C--N 1.346 0.443 0 CA-C-N 119.1 1.45 . . . . 25.0 114.437 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -140.07 159.71 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.816 -1.55 . . . . 25.0 106.816 178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 p -105.84 150.9 25.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.751 -1.204 . . . . 25.0 107.751 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -137.34 100.89 4.37 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 105.083 -2.191 . . . . 25.0 105.083 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.03 116.83 32.73 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.909 0.862 . . . . 25.0 109.811 -176.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -103.26 150.54 23.63 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.635 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -127.76 115.41 18.64 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 103.964 -2.606 . . . . 25.0 103.964 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -116.04 124.38 50.31 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.009 0.744 . . . . 25.0 113.009 -172.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.1 t -88.23 -1.93 58.3 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.05 0.452 . . . . 25.0 110.59 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.16 119.97 37.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.4 mmm180 -84.3 -0.13 51.28 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.925 1.454 . . . . 25.0 114.925 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.13 155.39 39.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 117.741 0.246 . . . . 25.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.6 t -74.14 155.95 37.87 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 114.879 1.437 . . . . 25.0 114.879 -171.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.406 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 7.3 t -90.73 162.61 14.82 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.01 -0.995 . . . . 25.0 108.552 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -117.89 -14.52 10.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.922 -0.769 . . . . 25.0 108.922 168.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 t -175.2 154.41 1.75 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.006 0.431 . . . . 25.0 111.213 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.1 m95 -116.99 130.65 56.83 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.861 -2.644 . . . . 25.0 103.861 165.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 53.0 mtt-85 -133.59 147.46 51.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.953 -1.128 . . . . 25.0 107.953 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -137.37 132.24 33.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 106.627 -1.62 . . . . 25.0 106.627 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.99 164.86 33.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.368 0.531 . . . . 25.0 110.69 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 167.99 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 113.249 0.833 . . . . 25.0 113.249 -167.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.3 p -83.76 161.5 20.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.879 -1.156 . . . . 25.0 107.879 168.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -61.88 158.19 44.92 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.159 -0.928 . . . . 25.0 109.796 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.79 -18.34 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 117.557 -1.162 . . . . 25.0 114.739 -173.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -120.84 31.71 6.29 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.166 0.432 . . . . 25.0 112.166 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -76.34 165.17 25.23 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.653 0.74 . . . . 25.0 110.889 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -87.54 101.02 13.22 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.167 -0.924 . . . . 25.0 110.272 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -79.09 18.54 0.64 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 115.749 1.759 . . . . 25.0 115.749 -174.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -117.77 -2.46 11.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.328 -0.619 . . . . 25.0 109.328 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -101.67 157.4 33.75 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.367 -0.833 . . . . 25.0 108.91 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -66.63 157.66 59.77 Favored 'Trans proline' 0 C--N 1.346 0.441 0 O-C-N 121.94 0.442 . . . . 25.0 112.233 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.64 105.45 4.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.507 0.67 . . . . 25.0 111.174 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 68.3 p -99.34 157.07 16.66 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.008 -0.738 . . . . 25.0 109.008 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -65.95 -26.13 67.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.139 0.495 . . . . 25.0 110.873 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.96 -24.99 60.86 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.506 -0.77 . . . . 25.0 112.239 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.1 t -83.44 -11.1 57.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.985 0.421 . . . . 25.0 111.54 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -94.18 156.71 16.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.715 1.006 . . . . 25.0 113.715 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -97.21 96.12 8.21 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 102.826 -3.027 . . . . 25.0 102.826 162.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.37 -7.54 32.24 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.711 1.004 . . . . 25.0 113.711 -171.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.76 122.7 78.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 108.124 -1.065 . . . . 25.0 108.124 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.91 139.79 36.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.362 -2.625 . . . . 25.0 111.996 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -87.7 -15.56 36.77 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.392 0.516 . . . . 25.0 112.392 -175.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.5 m -149.31 66.68 1.02 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.427 -0.351 . . . . 25.0 110.668 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -89.09 139.23 30.68 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 118.426 -1.31 . . . . 25.0 109.336 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -118.19 100.93 7.84 Favored 'General case' 0 CA--C 1.496 -1.113 0 N-CA-C 101.225 -3.62 . . . . 25.0 101.225 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -88.56 92.12 9.07 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 105.571 -2.011 . . . . 25.0 105.571 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.83 117.64 33.36 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.736 -1.579 . . . . 25.0 106.736 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.97 81.12 0.51 Allowed Glycine 0 CA--C 1.5 -0.855 0 CA-C-N 115.441 -0.8 . . . . 25.0 111.798 -173.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.21 16.85 5.54 Favored Glycine 0 C--N 1.32 -0.33 0 C-N-CA 120.86 -0.686 . . . . 25.0 114.283 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.87 104.18 5.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.629 -0.878 . . . . 25.0 108.629 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -75.84 127.56 85.24 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 107.54 -1.281 . . . . 25.0 107.54 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.44 153.77 60.79 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 117.985 -0.877 . . . . 25.0 113.842 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -98.8 30.88 3.14 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.982 -1.488 . . . . 25.0 106.982 177.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 72.74 -18.8 0.33 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.041 1.737 . . . . 25.0 111.705 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.426 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.5 mt-30 -129.23 151.51 49.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 104.941 -2.244 . . . . 25.0 104.941 171.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 47.6 t -144.08 95.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.495 -1.298 . . . . 25.0 107.495 -178.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -91.42 133.7 35.25 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 163.22 31.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 104.975 -2.231 . . . . 25.0 104.975 177.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -136.93 149.62 47.71 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 105.341 -2.096 . . . . 25.0 105.341 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 163.95 31.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.668 -1.234 . . . . 25.0 107.668 -178.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -102.01 118.78 37.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.439 0.162 . . . . 25.0 111.125 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.4 mt -76.25 132.23 73.69 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -63.34 147.53 93.54 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-O 121.692 0.622 . . . . 25.0 113.576 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.03 -26.15 43.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.25 -0.886 . . . . 25.0 112.769 -169.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -82.09 7.24 13.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.602 0.715 . . . . 25.0 110.113 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -114.44 52.29 0.84 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 107.812 -1.181 . . . . 25.0 107.812 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.92 11.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.041 -1.836 . . . . 25.0 106.041 173.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.68 -168.65 41.94 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 116.116 1.206 . . . . 25.0 116.116 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.15 109.14 18.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.45 0.643 . . . . 25.0 110.881 -169.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . 0.425 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.8 p-80 -158.24 171.32 20.41 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.91 -0.586 . . . . 25.0 111.406 -176.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.7 p -102.92 150.2 6.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 107.315 -1.365 . . . . 25.0 107.315 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.1 mt -133.21 127.81 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 102.201 -3.259 . . . . 25.0 102.201 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.0 mp -119.96 141.27 49.81 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.848 -0.614 . . . . 25.0 109.657 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.59 140.43 52.12 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.987 -0.745 . . . . 25.0 108.987 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -127.32 135.84 62.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.059 0.933 . . . . 25.0 112.325 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.406 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.7 t90 -95.11 111.43 23.25 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.876 -2.268 . . . . 25.0 104.876 170.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -98.16 119.33 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 -177.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.6 mm -86.44 141.35 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -170.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -83.52 -46.53 12.34 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.348 0.594 . . . . 25.0 110.848 175.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.16 -27.05 66.09 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.788 1.403 . . . . 25.0 114.788 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.2 p -138.06 164.29 29.47 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.172 -0.677 . . . . 25.0 109.172 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -77.85 26.79 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.621 0.971 . . . . 25.0 113.621 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -96.05 148.96 22.12 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.574 -0.704 . . . . 25.0 112.59 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.41 138.24 9.73 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 106.373 -1.714 . . . . 25.0 106.373 170.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -146.86 131.45 17.79 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.242 0.474 . . . . 25.0 112.204 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -91.18 118.01 30.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.156 -0.475 . . . . 25.0 111.449 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -96.99 113.92 25.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.423 -0.954 . . . . 25.0 108.423 178.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.47 142.95 27.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.746 -0.661 . . . . 25.0 112.713 -175.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.47 136.77 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.032 -2.21 . . . . 25.0 105.032 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -97.17 131.58 43.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.68 162.83 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 113.049 0.759 . . . . 25.0 113.049 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -120.06 95.07 4.6 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 167.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.86 161.09 15.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.158 0.799 . . . . 25.0 113.158 -171.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 66.0 p -145.85 166.45 25.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.83 -0.804 . . . . 25.0 108.83 175.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.755 0 CA-C-O 118.827 -0.606 . . . . 25.0 110.408 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.6 m80 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.471 0.653 . . . . 25.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.5 170.87 38.9 Favored Glycine 0 CA--C 1.509 -0.307 1 N-CA-C 101.282 -4.727 . . . . 25.0 101.282 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -141.72 154.92 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 120.144 1.972 . . . . 25.0 109.787 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.31 119.61 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 106.019 -1.845 . . . . 25.0 106.019 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.32 -44.61 36.05 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.314 -1.312 . . . . 25.0 110.338 -172.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -148.46 124.55 5.27 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -64.65 131.4 12.08 Favored 'Cis proline' 0 CA--C 1.536 0.617 0 C-N-CA 128.7 0.708 . . . . 25.0 111.766 -0.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.84 112.51 4.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -173.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 t -71.98 158.42 36.03 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.576 -0.528 . . . . 25.0 109.576 -178.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -55.33 -25.43 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.714 0.806 . . . . 25.0 112.08 178.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.33 -51.47 52.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.64 0.733 . . . . 25.0 109.296 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.13 -37.03 84.7 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.719 -0.673 . . . . 25.0 109.977 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.7 -32.46 73.56 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 122.344 -0.223 . . . . 25.0 110.97 178.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -40.82 96.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.559 . . . . 25.0 110.323 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.407 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.6 tmtm? -68.15 -34.44 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.27 0.557 . . . . 25.0 109.812 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.7 mt -78.0 6.58 7.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.043 -0.526 . . . . 25.0 111.681 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 59.15 23.19 11.43 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.218 1.407 . . . . 25.0 113.342 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.482 ' C ' HD21 ' A' ' 19' ' ' ASN . 90.2 mt -90.09 -21.08 22.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.491 -0.929 . . . . 25.0 108.491 174.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.482 HD21 ' C ' ' A' ' 18' ' ' LEU . 1.8 m120 -123.54 159.97 28.01 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 106.097 -1.816 . . . . 25.0 106.097 178.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 p -135.69 174.59 10.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.566 0.347 . . . . 25.0 111.126 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 66.93 4.99 3.78 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 116.855 2.169 . . . . 25.0 116.855 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -64.89 -38.99 92.83 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 121.664 -0.648 . . . . 25.0 111.261 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.57 1.58 Allowed Glycine 0 C--O 1.217 -0.948 0 O-C-N 123.733 0.646 . . . . 25.0 111.92 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 t -88.07 -52.27 5.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.574 1.178 . . . . 25.0 110.994 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -7.13 7.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.33 -1.305 . . . . 25.0 113.53 -171.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -90.74 -0.74 57.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.851 -0.531 . . . . 25.0 111.302 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -116.39 -34.02 4.75 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.259 -0.577 . . . . 25.0 109.748 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.94 102.44 24.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.461 -0.57 . . . . 25.0 109.461 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 92.6 Cg_endo -74.37 -20.54 18.34 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 117.383 -1.278 . . . . 25.0 113.955 -174.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -87.03 14.96 6.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.432 0.53 . . . . 25.0 112.432 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 61.5 m -65.09 -21.33 66.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.989 0.424 . . . . 25.0 111.651 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.67 125.96 22.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 115.274 1.583 . . . . 25.0 115.274 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -152.93 159.77 42.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.127 -1.805 . . . . 25.0 106.127 172.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.01 -167.47 21.51 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 107.661 -2.176 . . . . 25.0 107.661 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -119.33 150.67 39.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 118.31 1.055 . . . . 25.0 111.916 -177.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -65.29 152.85 42.74 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.089 -1.448 . . . . 25.0 107.089 172.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.14 2.07 1.65 Allowed Glycine 0 C--N 1.317 -0.498 0 CA-C-N 115.091 -0.958 . . . . 25.0 114.153 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -75.97 140.64 70.5 Favored Pre-proline 0 C--N 1.322 -0.619 0 O-C-N 121.605 -0.938 . . . . 25.0 109.369 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -93.23 -13.45 20.46 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 C-N-CA 130.473 1.447 . . . . 25.0 115.607 -6.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.84 -37.42 76.17 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.489 1.292 . . . . 25.0 114.489 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.48 30.5 7.26 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.57 -179.93 44.83 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 114.384 -1.28 . . . . 25.0 110.79 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -62.54 173.35 3.6 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.985 2.457 . . . . 25.0 113.356 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 160.04 31.05 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 107.207 -1.405 . . . . 25.0 107.207 173.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -60.66 139.69 57.75 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 107.204 -1.406 . . . . 25.0 107.204 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.51 -5.89 79.35 Favored Glycine 0 CA--C 1.511 -0.184 0 CA-C-N 116.232 -0.44 . . . . 25.0 112.628 -174.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -124.97 8.86 8.08 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.517 -0.402 . . . . 25.0 109.954 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.32 -49.48 80.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 122.047 -0.408 . . . . 25.0 111.502 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.33 -16.96 59.64 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.992 -0.442 . . . . 25.0 110.102 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.7 p -87.28 -7.56 57.71 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.02 30.89 10.14 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.521 0.729 . . . . 25.0 110.464 -172.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.97 37.25 24.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.357 1.243 . . . . 25.0 114.357 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.2 135.71 54.89 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.938 0.495 . . . . 25.0 110.807 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 p -61.44 -34.78 76.0 Favored 'General case' 0 C--O 1.213 -0.827 0 N-CA-C 114.627 1.343 . . . . 25.0 114.627 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -69.2 -8.56 46.86 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -178.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -122.68 12.48 9.92 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 108.123 -1.065 . . . . 25.0 108.123 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -70.71 -39.58 73.36 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.901 -1.125 . . . . 25.0 111.176 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -73.38 -11.06 60.35 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.697 0.761 . . . . 25.0 109.423 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mp -88.14 -3.09 58.93 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.768 -0.826 . . . . 25.0 108.768 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -114.11 -34.02 5.5 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.973 0.416 . . . . 25.0 111.357 172.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -86.6 116.1 24.5 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 121.78 -0.575 . . . . 25.0 110.375 -178.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.462 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.8 pm0 -125.46 160.9 28.31 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.401 0.619 . . . . 25.0 110.658 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.1 p -119.88 160.22 43.56 Favored Pre-proline 0 C--N 1.317 -0.816 1 N-CA-C 99.719 -4.178 . . . . 25.0 99.719 160.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.17 -2.63 10.79 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 N-CA-C 116.094 1.536 . . . . 25.0 116.094 -173.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -121.21 9.76 10.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.182 0.515 . . . . 25.0 111.361 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -79.65 -28.66 40.84 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.243 0.831 . . . . 25.0 113.243 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.2 m95 -126.6 168.35 14.43 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.773 0.321 . . . . 25.0 111.259 -176.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -69.6 119.38 13.75 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 106.75 -1.574 . . . . 25.0 106.75 171.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.3 mmtt -93.29 103.08 15.35 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 101.183 -3.636 . . . . 25.0 101.183 177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.79 135.58 55.07 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.917 -1.038 . . . . 25.0 110.621 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -89.69 102.41 15.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.177 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.6 173.85 10.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.577 -1.268 . . . . 25.0 107.577 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.16 157.36 24.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.937 -0.574 . . . . 25.0 111.243 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.4 p -76.96 168.83 19.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 106.877 -1.527 . . . . 25.0 106.877 171.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.93 -160.93 26.56 Favored Glycine 0 C--O 1.239 0.468 0 N-CA-C 110.424 -1.071 . . . . 25.0 110.424 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.95 131.51 42.16 Favored 'Trans proline' 0 C--N 1.347 0.449 0 CA-C-N 119.061 1.43 . . . . 25.0 114.177 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -137.91 161.94 35.34 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 106.7 -1.592 . . . . 25.0 106.7 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.8 p -103.39 149.49 24.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.392 -1.336 . . . . 25.0 107.392 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -137.57 101.06 4.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.042 -2.207 . . . . 25.0 105.042 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.8 113.99 27.87 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.224 1.011 . . . . 25.0 110.046 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -95.48 146.94 24.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.028 -0.987 . . . . 25.0 108.697 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -124.97 114.45 19.15 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 103.655 -2.72 . . . . 25.0 103.655 179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.12 138.51 48.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.477 -0.783 . . . . 25.0 110.037 -173.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.0 t -101.0 14.53 31.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.241 1.02 . . . . 25.0 109.136 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.5 134.85 29.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.899 -0.591 . . . . 25.0 110.079 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -90.1 5.65 45.87 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.588 0.588 . . . . 25.0 112.588 -179.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.79 153.25 42.38 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.904 -0.406 . . . . 25.0 109.904 178.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 t -74.36 156.07 37.47 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.264 1.209 . . . . 25.0 114.264 -170.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -102.93 157.42 16.99 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -118.01 -14.93 9.97 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 111.541 0.2 . . . . 25.0 111.541 173.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.5 t -172.45 154.26 3.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.975 0.417 . . . . 25.0 111.897 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -126.63 139.05 53.47 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 104.3 -2.481 . . . . 25.0 104.3 167.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 16.8 mtt-85 -144.9 150.61 37.34 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.446 -0.946 . . . . 25.0 108.446 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -137.69 136.22 37.2 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.333 -1.728 . . . . 25.0 106.333 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -148.52 162.43 39.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.515 0.598 . . . . 25.0 110.022 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.99 166.0 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 113.478 0.918 . . . . 25.0 113.478 -167.197 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -80.98 162.39 23.86 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.688 -1.227 . . . . 25.0 107.688 169.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -62.39 158.39 48.58 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.31 -0.859 . . . . 25.0 108.994 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.03 -23.33 34.25 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 116.565 -1.823 . . . . 25.0 114.272 -173.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -113.87 32.06 6.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.576 0.351 . . . . 25.0 111.499 -175.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.4 p-90 -76.14 164.31 26.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.98 0.895 . . . . 25.0 112.541 -176.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -83.04 100.93 10.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.523 -1.217 . . . . 25.0 110.101 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.09 12.88 10.43 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.662 2.097 . . . . 25.0 116.662 -170.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.7 t -121.08 7.91 10.35 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.561 -0.903 . . . . 25.0 108.561 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.22 159.52 32.51 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 107.388 -1.338 . . . . 25.0 107.388 -174.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 158.04 57.04 Favored 'Trans proline' 0 C--N 1.346 0.435 0 O-C-N 121.894 0.418 . . . . 25.0 113.08 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.59 106.32 3.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.898 0.38 . . . . 25.0 110.522 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -103.42 153.66 20.26 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.808 -0.812 . . . . 25.0 108.808 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -64.69 -25.14 67.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.0 0.429 . . . . 25.0 111.484 177.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.12 64.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.623 -0.717 . . . . 25.0 112.221 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.1 t -80.66 -21.06 41.74 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.632 0.73 . . . . 25.0 110.983 -178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -86.56 152.1 22.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 115.2 1.555 . . . . 25.0 115.2 -176.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -95.67 92.82 6.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 102.692 -3.077 . . . . 25.0 102.692 163.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.42 -6.25 13.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -170.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -84.93 131.68 48.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.66 140.91 27.07 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 115.779 -2.347 . . . . 25.0 112.369 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -92.16 -11.87 34.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.382 0.512 . . . . 25.0 112.382 -177.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.4 m -148.98 66.75 1.04 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.503 0.321 . . . . 25.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -88.99 133.52 34.3 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 118.357 -1.337 . . . . 25.0 109.027 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -118.89 99.08 6.52 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 102.715 -3.069 . . . . 25.0 102.715 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -91.53 91.95 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.446 -1.687 . . . . 25.0 106.446 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -110.45 117.28 33.15 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.808 -1.182 . . . . 25.0 107.808 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.01 78.67 0.87 Allowed Glycine 0 CA--C 1.502 -0.772 0 CA-C-N 115.072 -0.967 . . . . 25.0 113.787 -169.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.59 22.21 6.82 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 121.015 -0.612 . . . . 25.0 113.906 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.67 106.71 4.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.802 0.811 . . . . 25.0 109.284 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.32 122.87 88.3 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.975 -1.121 . . . . 25.0 107.975 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -77.92 168.36 22.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 N-CA-C 114.633 0.974 . . . . 25.0 114.633 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.403 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -109.21 33.26 4.38 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.83 -18.36 0.31 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.823 1.649 . . . . 25.0 112.76 -177.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.403 ' H ' ' C ' ' A' ' 128' ' ' ALA . 64.0 mt-30 -128.58 152.8 47.91 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 104.823 -2.288 . . . . 25.0 104.823 168.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -140.49 95.02 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.0 m -94.85 122.75 37.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.109 -1.441 . . . . 25.0 107.109 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.69 167.05 19.44 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 105.73 -1.952 . . . . 25.0 105.73 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -130.31 151.0 51.29 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.256 -2.128 . . . . 25.0 105.256 175.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 160.5 38.4 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.219 -1.401 . . . . 25.0 107.219 -177.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -103.28 115.8 31.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.091 0.245 . . . . 25.0 111.072 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.29 132.45 73.14 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 107.508 -1.293 . . . . 25.0 107.508 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.47 146.74 96.79 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-O 121.699 0.625 . . . . 25.0 113.519 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.91 37.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.219 -0.9 . . . . 25.0 112.658 -168.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -85.46 10.42 12.97 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.622 0.725 . . . . 25.0 110.103 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -116.53 53.53 0.88 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 171.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -85.99 170.97 11.8 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 84.95 -168.3 42.98 Favored Glycine 0 C--N 1.321 -0.295 0 N-CA-C 116.157 1.223 . . . . 25.0 116.157 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.5 t -85.9 108.87 18.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 25.0 111.097 -168.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -157.46 171.38 20.48 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.993 -0.548 . . . . 25.0 111.388 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.42 151.04 7.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 107.963 -1.125 . . . . 25.0 107.963 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -133.79 122.45 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -106.54 133.39 51.3 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.71 -0.677 . . . . 25.0 109.921 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.24 135.32 53.33 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 122.939 0.495 . . . . 25.0 110.227 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.96 145.87 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 122.13 0.967 . . . . 25.0 112.901 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -113.63 112.95 24.36 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.929 -1.878 . . . . 25.0 105.929 172.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.3 122.27 35.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.707 -1.22 . . . . 25.0 107.707 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 15.5 mm -79.14 141.72 14.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.153 -0.684 . . . . 25.0 109.153 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.32 -42.34 23.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.75 0.704 . . . . 25.0 109.845 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.88 -23.87 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.75 1.018 . . . . 25.0 113.75 -172.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 49.0 p -138.8 169.65 17.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.867 0.841 . . . . 25.0 110.149 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.92 19.01 0.91 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.308 -0.86 . . . . 25.0 112.356 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.05 146.17 24.53 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.26 0.837 . . . . 25.0 113.26 -175.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.65 143.19 11.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 105.291 -2.114 . . . . 25.0 105.291 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -148.06 128.35 13.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 111.632 0.234 . . . . 25.0 111.632 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -86.82 118.34 26.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.032 0.444 . . . . 25.0 110.679 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -96.99 115.44 27.43 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.258 -1.016 . . . . 25.0 108.258 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.7 142.38 29.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.131 -0.486 . . . . 25.0 111.921 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -127.15 136.22 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 105.1 -2.185 . . . . 25.0 105.1 166.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -97.02 130.63 44.31 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.054 -1.461 . . . . 25.0 107.054 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.17 162.5 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 113.101 0.778 . . . . 25.0 113.101 -174.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.67 94.99 4.66 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 104.382 -2.451 . . . . 25.0 104.382 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.54 163.76 14.48 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.4 p -145.9 164.09 33.08 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.954 -1.128 . . . . 25.0 107.954 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.42 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-O 117.74 -1.124 . . . . 25.0 111.536 -177.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 121.086 0.469 . . . . 25.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.67 170.88 22.99 Favored Glycine 0 CA--C 1.509 -0.342 1 N-CA-C 101.652 -4.579 . . . . 25.0 101.652 -175.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -146.62 163.16 36.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 120.297 2.049 . . . . 25.0 110.687 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -97.86 121.87 48.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -41.79 53.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.624 -1.171 . . . . 25.0 109.863 -174.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.64 129.3 5.17 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 106.018 -1.845 . . . . 25.0 106.018 176.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -64.46 132.25 13.62 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 128.751 0.73 . . . . 25.0 111.093 -0.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.78 112.61 4.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.038 -0.528 . . . . 25.0 111.855 -172.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.8 t -71.93 158.34 36.2 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 108.185 -1.043 . . . . 25.0 108.185 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -55.57 -24.77 34.49 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.304 0.642 . . . . 25.0 112.049 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.17 -53.78 33.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.819 0.819 . . . . 25.0 109.43 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -67.65 -35.09 78.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.505 -0.77 . . . . 25.0 110.564 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.68 -33.0 74.66 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.111 -0.368 . . . . 25.0 110.734 178.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -40.79 98.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.347 0.594 . . . . 25.0 109.555 177.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -67.85 -35.03 77.85 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.215 0.531 . . . . 25.0 110.185 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.69 5.47 9.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 25.0 111.436 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 59.1 24.95 13.32 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.097 1.359 . . . . 25.0 112.78 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.451 ' C ' HD21 ' A' ' 19' ' ' ASN . 89.1 mt -91.14 -21.84 20.98 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.131 -1.063 . . . . 25.0 108.131 174.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.451 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -124.06 159.9 28.88 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.011 -1.848 . . . . 25.0 106.011 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.2 p -134.73 175.49 9.5 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 122.261 0.225 . . . . 25.0 110.508 -176.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 70.21 5.08 5.15 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.574 1.694 . . . . 25.0 115.574 175.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.9 m -66.66 -38.49 86.95 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 121.412 -0.805 . . . . 25.0 110.565 172.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.63 -63.94 1.48 Allowed Glycine 0 C--O 1.218 -0.861 0 O-C-N 123.754 0.659 . . . . 25.0 112.114 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.3 t -88.06 -52.82 5.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.423 1.106 . . . . 25.0 111.098 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.64 -9.97 12.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.697 -1.138 . . . . 25.0 113.54 -171.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.97 -3.06 58.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.857 -0.527 . . . . 25.0 111.266 177.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -116.25 -34.02 4.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.456 -0.572 . . . . 25.0 109.456 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -126.9 97.67 32.24 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 109.989 -0.375 . . . . 25.0 109.989 173.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -74.97 -20.73 16.65 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 118.041 -0.839 . . . . 25.0 113.956 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -84.14 11.01 8.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.471 0.545 . . . . 25.0 112.471 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.7 m -64.83 -22.57 67.02 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.448 0.536 . . . . 25.0 112.448 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.1 m -64.04 121.42 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 115.12 1.526 . . . . 25.0 115.12 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -152.82 158.54 42.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 106.517 -1.66 . . . . 25.0 106.517 174.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.47 -166.18 18.76 Favored Glycine 0 N--CA 1.453 -0.209 0 N-CA-C 108.094 -2.003 . . . . 25.0 108.094 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -120.02 148.67 43.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.382 1.091 . . . . 25.0 112.079 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.39 157.0 33.0 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 171.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.25 2.02 1.64 Allowed Glycine 0 C--O 1.224 -0.493 0 CA-C-N 114.802 -1.09 . . . . 25.0 113.766 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -75.94 139.31 69.47 Favored Pre-proline 0 C--N 1.322 -0.622 0 O-C-N 121.576 -0.955 . . . . 25.0 110.067 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -93.45 -14.8 17.08 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 C-N-CA 130.35 1.396 . . . . 25.0 115.613 -6.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -70.98 -35.82 72.27 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.936 1.458 . . . . 25.0 114.936 -168.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -121.39 31.63 6.24 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 105.553 -2.018 . . . . 25.0 105.553 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.48 -177.61 41.45 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 114.389 -1.278 . . . . 25.0 111.749 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.3 172.5 3.26 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 123.505 2.803 . . . . 25.0 113.498 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 160.01 31.03 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.141 -1.429 . . . . 25.0 107.141 173.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -61.21 139.13 58.19 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.249 -1.389 . . . . 25.0 107.249 175.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.06 86.37 Favored Glycine 0 C--O 1.228 -0.275 0 CA-C-N 116.079 -0.51 . . . . 25.0 112.593 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -125.58 9.58 7.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.906 -0.775 . . . . 25.0 108.906 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.38 -49.51 74.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 122.132 -0.355 . . . . 25.0 111.631 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.1 -25.39 59.77 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.637 -0.505 . . . . 25.0 109.637 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.4 p -79.85 -9.77 59.7 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.181 0.437 . . . . 25.0 112.181 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.37 34.4 14.93 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.857 0.863 . . . . 25.0 109.984 -172.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.23 39.26 25.95 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.951 1.463 . . . . 25.0 114.951 -177.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -120.16 134.63 55.21 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.992 0.517 . . . . 25.0 110.614 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -61.68 -35.76 78.9 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 115.368 1.618 . . . . 25.0 115.368 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.03 -7.18 44.6 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.308 0.575 . . . . 25.0 112.456 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 59' ' ' LEU . 12.7 m-85 -121.74 13.47 10.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -72.14 -37.29 69.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.192 -0.942 . . . . 25.0 110.841 -175.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.7 mp0 -69.81 -17.02 63.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.85 0.833 . . . . 25.0 109.802 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.26 -5.47 59.32 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.902 -0.777 . . . . 25.0 108.902 -177.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.55 -32.82 6.34 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.561 0.578 . . . . 25.0 112.561 173.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -97.61 119.49 36.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 O-C-N 121.458 -0.776 . . . . 25.0 110.629 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.48 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -123.92 160.95 26.39 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.383 -0.826 . . . . 25.0 109.596 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -117.29 162.48 27.91 Favored Pre-proline 0 C--N 1.317 -0.824 1 N-CA-C 99.908 -4.108 . . . . 25.0 99.908 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.33 -5.34 15.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 116.559 -1.828 . . . . 25.0 115.763 -174.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.25 10.38 9.29 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.177 0.513 . . . . 25.0 111.77 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -78.8 -28.77 44.62 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.042 0.756 . . . . 25.0 113.042 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.48 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.1 m95 -126.94 165.41 19.46 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 120.787 0.327 . . . . 25.0 110.463 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.58 131.41 45.95 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 105.959 -1.867 . . . . 25.0 105.959 170.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -101.2 106.85 18.11 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 101.06 -3.681 . . . . 25.0 101.06 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.21 136.18 51.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.952 -1.022 . . . . 25.0 110.329 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -90.23 104.04 16.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.802 -1.09 . . . . 25.0 108.478 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.3 mt -129.92 173.91 10.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.542 -1.281 . . . . 25.0 107.542 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.59 157.64 24.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.768 -0.651 . . . . 25.0 111.472 -174.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 69.6 p -77.04 169.52 18.18 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.154 -1.425 . . . . 25.0 107.154 172.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.2 -161.69 27.93 Favored Glycine 0 C--O 1.239 0.413 0 N-CA-C 110.702 -0.959 . . . . 25.0 110.702 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.88 132.2 46.28 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 119.012 1.406 . . . . 25.0 113.964 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -137.26 160.88 37.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.289 -1.745 . . . . 25.0 106.289 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.5 p -104.84 152.03 23.09 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.53 -1.285 . . . . 25.0 107.53 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -139.15 101.06 4.18 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.37 -2.085 . . . . 25.0 105.37 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.1 113.45 26.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.977 0.894 . . . . 25.0 109.924 -178.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -99.59 145.13 27.88 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.184 -0.917 . . . . 25.0 110.055 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -123.19 108.91 13.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.968 -2.234 . . . . 25.0 104.968 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -104.83 135.46 46.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.601 -0.727 . . . . 25.0 109.86 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.7 t -101.28 17.67 21.96 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.723 0.773 . . . . 25.0 109.95 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.29 141.35 33.94 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.992 -0.744 . . . . 25.0 108.992 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -85.29 -4.85 59.3 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.662 0.615 . . . . 25.0 112.662 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.85 155.13 31.51 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.564 0.579 . . . . 25.0 112.564 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -74.39 155.83 37.68 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -173.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.443 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 9.8 t -99.09 157.94 16.0 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.013 -1.106 . . . . 25.0 108.013 173.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -117.75 -16.62 10.0 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.738 0.273 . . . . 25.0 111.738 172.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 t -171.91 152.44 2.99 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.869 0.366 . . . . 25.0 111.886 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -124.95 139.63 53.65 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.389 -2.449 . . . . 25.0 104.389 167.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -144.56 148.67 34.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.128 -1.064 . . . . 25.0 108.128 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.95 134.69 35.24 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.64 161.37 42.31 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.364 0.529 . . . . 25.0 110.187 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 163.15 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.52 0.933 . . . . 25.0 113.52 -167.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 p -77.46 161.15 28.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.811 -1.181 . . . . 25.0 107.811 171.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -61.44 157.24 47.28 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.044 -0.98 . . . . 25.0 109.16 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.89 -23.6 34.75 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.95 -1.566 . . . . 25.0 114.13 -172.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -113.36 32.01 6.07 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 122.621 0.368 . . . . 25.0 111.544 -174.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.513 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -78.7 163.68 25.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.838 0.827 . . . . 25.0 111.587 -177.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -87.86 100.98 13.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.844 -1.071 . . . . 25.0 110.393 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.513 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -78.85 21.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 116.158 1.91 . . . . 25.0 116.158 -173.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -120.74 -0.78 10.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.37 0.605 . . . . 25.0 109.826 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -101.64 156.49 35.13 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.376 -0.829 . . . . 25.0 108.806 -176.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.39 158.27 57.84 Favored 'Trans proline' 0 C--N 1.346 0.437 0 O-C-N 121.882 0.411 . . . . 25.0 111.525 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.99 97.61 1.91 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.324 0.583 . . . . 25.0 112.105 -176.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.7 p -91.87 152.94 19.85 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.474 -0.935 . . . . 25.0 108.474 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -65.26 -25.48 67.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.246 0.546 . . . . 25.0 111.049 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.87 -27.1 66.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.419 -0.81 . . . . 25.0 112.295 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 t -84.65 -5.87 59.33 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.054 0.391 . . . . 25.0 112.054 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -100.7 154.21 18.8 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 114.105 1.15 . . . . 25.0 114.105 -175.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -94.59 93.92 7.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 102.633 -3.099 . . . . 25.0 102.633 163.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.34 -7.3 23.6 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -169.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.8 t -83.68 128.31 64.18 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 176.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.71 146.51 48.79 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 115.278 -2.682 . . . . 25.0 111.336 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -97.11 -10.23 26.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.979 0.419 . . . . 25.0 111.527 -177.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.3 m -148.97 67.25 1.04 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.57 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -88.98 132.33 34.77 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 118.967 -1.093 . . . . 25.0 108.79 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -124.41 98.98 5.98 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 104.738 -2.319 . . . . 25.0 104.738 177.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -92.55 92.16 7.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -103.74 117.61 34.78 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 107.278 -1.379 . . . . 25.0 107.278 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -97.71 78.35 0.63 Allowed Glycine 0 CA--C 1.504 -0.636 0 CA-C-N 115.447 -0.797 . . . . 25.0 114.021 -169.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 112.3 22.0 6.01 Favored Glycine 0 C--N 1.321 -0.28 0 C-N-CA 120.817 -0.706 . . . . 25.0 113.203 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.68 107.03 5.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.531 0.681 . . . . 25.0 109.363 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.06 123.0 88.61 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 106.036 -1.838 . . . . 25.0 106.036 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.91 171.6 17.69 Favored 'Trans proline' 0 C--N 1.345 0.343 0 N-CA-C 113.715 0.621 . . . . 25.0 113.715 -175.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.11 27.27 5.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.581 -0.896 . . . . 25.0 108.581 176.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.56 -17.77 0.27 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.716 1.607 . . . . 25.0 112.365 -174.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 128' ' ' ALA . 67.5 mt-30 -127.23 153.33 46.24 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 103.494 -2.78 . . . . 25.0 103.494 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 69.5 t -141.41 95.08 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.604 0 N-CA-C 106.263 -1.754 . . . . 25.0 106.263 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.5 t -85.96 143.79 27.98 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 103.557 -2.757 . . . . 25.0 103.557 172.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.04 167.0 29.86 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.933 -1.485 . . . . 25.0 107.59 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -134.67 156.05 49.44 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.654 -1.61 . . . . 25.0 106.654 174.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.6 160.34 25.71 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.098 -1.445 . . . . 25.0 107.098 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -104.75 116.96 32.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.054 0.222 . . . . 25.0 110.979 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.86 132.12 68.66 Favored Pre-proline 0 CA--C 1.54 0.576 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -61.96 147.94 94.14 Favored 'Trans proline' 0 C--N 1.352 0.716 0 CA-C-O 121.652 0.605 . . . . 25.0 113.474 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.57 -26.54 34.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.32 -0.855 . . . . 25.0 112.594 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -83.6 10.1 9.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.602 0.715 . . . . 25.0 110.305 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.3 mmt-85 -116.34 50.0 1.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.568 -0.901 . . . . 25.0 108.568 172.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 35.9 p -86.0 164.94 17.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.672 -1.603 . . . . 25.0 106.672 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.97 -167.94 31.0 Favored Glycine 0 N--CA 1.451 -0.339 0 N-CA-C 115.043 0.777 . . . . 25.0 115.043 177.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -85.99 111.03 19.89 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.369 0.604 . . . . 25.0 110.908 -168.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 48.5 p-80 -159.14 171.08 20.59 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 115.913 -0.585 . . . . 25.0 111.241 -176.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.0 p -104.75 150.5 7.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.6 mt -132.24 120.99 45.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.83 131.53 52.19 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.394 -0.821 . . . . 25.0 109.62 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -123.59 133.14 54.0 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.519 -0.549 . . . . 25.0 109.519 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.46 143.78 36.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 122.073 0.939 . . . . 25.0 112.356 -178.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.443 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.8 t90 -113.8 113.22 24.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.872 -1.899 . . . . 25.0 105.872 173.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.64 125.74 38.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.981 -1.118 . . . . 25.0 107.981 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.6 mm -80.71 142.1 14.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.901 -0.777 . . . . 25.0 108.901 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.53 -43.49 22.99 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 118.806 0.73 . . . . 25.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.2 -23.24 64.81 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.749 1.018 . . . . 25.0 113.749 -172.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.1 p -138.63 168.76 19.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.962 0.887 . . . . 25.0 110.022 -175.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.88 21.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.216 -0.902 . . . . 25.0 112.313 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -91.63 145.27 24.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.076 0.769 . . . . 25.0 113.076 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.55 143.58 13.29 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 105.106 -2.183 . . . . 25.0 105.106 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -148.55 129.77 14.62 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.137 0.421 . . . . 25.0 112.137 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -85.53 117.37 24.39 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 121.105 0.479 . . . . 25.0 111.063 177.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -97.12 108.19 20.87 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.318 -1.364 . . . . 25.0 107.318 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.16 142.76 30.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.829 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -126.9 136.1 61.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 105.424 -2.065 . . . . 25.0 105.424 168.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -97.02 129.11 44.52 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.51 163.07 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.157 0.799 . . . . 25.0 113.157 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -117.83 95.28 4.85 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 103.994 -2.595 . . . . 25.0 103.994 166.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.6 tp -89.94 163.04 15.12 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 120.909 0.385 . . . . 25.0 111.652 -172.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.0 p -145.85 158.03 43.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.413 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 118.113 -0.946 . . . . 25.0 111.368 -178.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.0 m170 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 110.599 -0.149 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.23 166.09 11.89 Favored Glycine 0 N--CA 1.459 0.217 1 N-CA-C 102.758 -4.137 . . . . 25.0 102.758 -174.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.2 p90 -149.38 168.12 24.27 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.444 2.122 . . . . 25.0 111.921 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -103.82 124.37 58.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.565 -1.272 . . . . 25.0 107.565 176.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.89 -43.18 30.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.922 -1.036 . . . . 25.0 109.968 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -152.89 129.8 5.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.923 -1.88 . . . . 25.0 105.923 176.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.76 130.79 9.84 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.933 0.806 . . . . 25.0 111.451 0.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.76 4.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.875 -0.602 . . . . 25.0 112.11 -172.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.7 t -72.14 157.34 37.93 Favored 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 108.667 -0.864 . . . . 25.0 108.667 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -55.2 -25.61 33.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.726 0.81 . . . . 25.0 111.924 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.26 30.21 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.824 0.821 . . . . 25.0 109.157 175.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -66.48 -35.74 81.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.498 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.3 -33.36 75.35 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 122.157 -0.34 . . . . 25.0 110.849 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -39.79 94.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.225 0.536 . . . . 25.0 109.862 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -68.21 -35.19 77.59 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.226 0.536 . . . . 25.0 110.034 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -77.77 4.4 11.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 25.0 111.278 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 58.95 22.39 10.29 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.175 1.39 . . . . 25.0 112.975 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.444 ' C ' HD21 ' A' ' 19' ' ' ASN . 92.8 mt -86.55 -21.69 26.76 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 174.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.444 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -123.75 158.81 30.84 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 105.435 -2.061 . . . . 25.0 105.435 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.3 p -135.81 176.95 8.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.439 -0.578 . . . . 25.0 109.439 -176.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 71.3 5.13 5.33 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.442 1.645 . . . . 25.0 115.442 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -68.76 -38.13 79.87 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 121.53 -0.732 . . . . 25.0 110.821 174.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.8 -63.62 1.55 Allowed Glycine 0 C--O 1.217 -0.924 0 O-C-N 123.713 0.633 . . . . 25.0 112.116 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.8 t -88.0 -53.31 4.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 122.503 1.144 . . . . 25.0 111.643 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.28 -11.11 13.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.563 -1.199 . . . . 25.0 113.239 -171.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -86.91 -2.71 58.81 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.751 -0.593 . . . . 25.0 111.479 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -116.25 -34.11 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.129 -0.628 . . . . 25.0 109.594 173.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -126.9 92.44 44.55 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 120.926 0.393 . . . . 25.0 111.463 171.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -74.15 -19.13 20.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 117.66 -1.093 . . . . 25.0 114.022 -176.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.99 5.38 41.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.231 0.456 . . . . 25.0 112.231 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -2.28 24.33 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.993 0.738 . . . . 25.0 112.993 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.432 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.3 m -64.08 138.03 23.76 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 N-CA-C 113.343 0.868 . . . . 25.0 113.343 -177.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -153.02 152.28 31.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.345 -0.843 . . . . 25.0 108.779 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.58 -176.35 33.58 Favored Glycine 0 N--CA 1.452 -0.256 0 N-CA-C 107.346 -2.302 . . . . 25.0 107.346 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.84 150.3 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 118.364 1.082 . . . . 25.0 111.758 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.52 156.98 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.602 -1.258 . . . . 25.0 107.602 172.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.82 -1.74 3.57 Favored Glycine 0 C--O 1.224 -0.504 0 CA-C-N 114.756 -1.111 . . . . 25.0 112.797 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -75.98 142.1 72.22 Favored Pre-proline 0 C--N 1.322 -0.617 0 O-C-N 121.546 -0.973 . . . . 25.0 109.374 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -91.89 -13.74 23.15 Favored 'Cis proline' 0 CA--C 1.541 0.87 0 C-N-CA 130.065 1.277 . . . . 25.0 115.227 -6.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -70.71 -37.81 73.57 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.782 1.401 . . . . 25.0 114.782 -169.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.79 34.95 5.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.118 -1.808 . . . . 25.0 106.118 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.45 -174.41 46.06 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 114.613 -1.176 . . . . 25.0 111.311 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -59.8 173.71 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 124.257 3.305 . . . . 25.0 113.049 176.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.95 159.92 31.22 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.915 -1.513 . . . . 25.0 106.915 173.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -61.03 139.36 58.08 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.24 -5.05 81.98 Favored Glycine 0 C--O 1.228 -0.224 0 CA-C-N 116.06 -0.518 . . . . 25.0 112.826 -174.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -124.2 10.88 8.74 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.26 -0.644 . . . . 25.0 109.26 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.63 -49.96 74.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 122.272 -0.267 . . . . 25.0 111.291 -174.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.39 -24.66 59.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.709 -0.478 . . . . 25.0 109.709 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 p -80.45 -9.74 59.75 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.269 0.47 . . . . 25.0 112.269 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.28 34.43 14.73 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.689 0.795 . . . . 25.0 110.267 -172.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.55 41.16 26.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.467 1.284 . . . . 25.0 114.467 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -121.31 136.26 54.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.345 0.658 . . . . 25.0 110.529 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -63.5 -35.26 79.89 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -175.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.03 -7.12 47.01 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.621 0.6 . . . . 25.0 112.621 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 14.4 m-85 -120.13 13.58 12.1 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 107.14 -1.43 . . . . 25.0 107.14 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.54 -35.71 68.1 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.998 -1.064 . . . . 25.0 110.604 -175.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 -69.26 -17.37 63.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.923 0.868 . . . . 25.0 109.646 174.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.405 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.44 -5.36 59.18 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.485 -0.78 . . . . 25.0 109.007 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -113.97 -32.6 6.01 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.284 0.476 . . . . 25.0 112.284 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -91.65 115.89 28.42 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 121.583 -0.698 . . . . 25.0 110.34 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.46 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -125.17 161.02 27.79 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.149 -0.686 . . . . 25.0 109.149 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -116.55 163.96 20.2 Favored Pre-proline 0 C--N 1.317 -0.827 0 N-CA-C 100.348 -3.945 . . . . 25.0 100.348 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.88 -4.04 12.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 116.74 -1.707 . . . . 25.0 115.86 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -127.98 12.52 6.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.355 0.598 . . . . 25.0 111.506 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -76.6 -28.8 56.28 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.283 0.846 . . . . 25.0 113.283 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.46 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.4 m95 -126.14 167.12 15.83 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 120.598 0.237 . . . . 25.0 110.557 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -66.68 119.86 12.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.815 -1.921 . . . . 25.0 105.815 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -94.0 103.5 15.58 Favored 'General case' 0 CA--C 1.5 -0.975 1 N-CA-C 100.094 -4.039 . . . . 25.0 100.094 177.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.31 135.05 54.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.926 -1.034 . . . . 25.0 110.312 -176.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -90.4 101.09 13.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.648 -1.16 . . . . 25.0 108.296 -177.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -129.38 173.89 10.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.673 -1.232 . . . . 25.0 107.673 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.25 155.36 25.21 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 25.0 111.709 -174.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 66.9 p -76.99 167.99 20.87 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.1 -160.89 25.18 Favored Glycine 0 C--O 1.24 0.487 0 N-CA-C 110.609 -0.997 . . . . 25.0 110.609 -178.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.99 133.62 54.67 Favored 'Trans proline' 0 C--N 1.346 0.446 0 CA-C-N 119.019 1.41 . . . . 25.0 113.931 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -138.79 160.74 38.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.797 -1.557 . . . . 25.0 106.797 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -103.1 151.12 22.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.329 -1.359 . . . . 25.0 107.329 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -138.57 101.04 4.25 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 105.455 -2.054 . . . . 25.0 105.455 -177.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.61 116.45 32.09 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.949 0.88 . . . . 25.0 109.132 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -104.07 150.37 24.35 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.218 -0.901 . . . . 25.0 109.794 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -127.79 111.67 13.91 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.0 mp -109.22 122.36 47.16 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.633 -0.712 . . . . 25.0 111.71 -173.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.5 17.69 4.39 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.479 0.657 . . . . 25.0 111.227 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.33 140.37 33.77 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 121.615 -0.678 . . . . 25.0 110.133 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -82.55 -8.55 59.6 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.852 -0.613 . . . . 25.0 112.025 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -63.8 156.18 28.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -175.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.6 t -83.36 155.99 23.25 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 114.239 1.2 . . . . 25.0 114.239 -171.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -99.65 157.22 16.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.876 -0.602 . . . . 25.0 109.469 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -117.94 -14.22 10.03 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.559 0.207 . . . . 25.0 111.559 172.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.1 t -172.61 150.31 2.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.807 0.337 . . . . 25.0 111.824 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -122.86 139.5 53.95 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 104.521 -2.4 . . . . 25.0 104.521 166.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -144.75 151.83 39.45 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.454 -1.313 . . . . 25.0 107.454 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.94 134.39 34.89 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.75 -1.945 . . . . 25.0 105.75 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 164.01 34.72 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.345 0.52 . . . . 25.0 109.881 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.92 164.28 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 113.481 0.919 . . . . 25.0 113.481 -167.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -78.65 162.36 26.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -62.07 157.77 49.78 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.264 -0.88 . . . . 25.0 109.065 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.33 -25.34 36.31 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 116.534 -1.844 . . . . 25.0 114.036 -173.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -113.0 31.99 6.03 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.694 0.397 . . . . 25.0 110.882 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.512 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.67 165.02 25.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.031 0.919 . . . . 25.0 112.982 -175.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -83.1 100.93 10.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.496 -1.229 . . . . 25.0 109.857 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -88.14 12.2 14.28 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 116.693 2.109 . . . . 25.0 116.693 -169.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.4 t -119.23 6.45 11.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 176.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -109.71 156.62 39.44 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.666 -1.152 . . . . 25.0 108.042 -174.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.53 156.85 64.39 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 O-C-N 121.942 0.443 . . . . 25.0 111.847 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.05 105.17 3.24 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.28 0.562 . . . . 25.0 112.075 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.0 p -98.64 154.82 17.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.772 -0.825 . . . . 25.0 108.772 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -65.0 -26.05 68.12 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.913 -0.492 . . . . 25.0 111.484 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.84 -26.95 65.41 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.702 -0.681 . . . . 25.0 112.112 176.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 35.3 t -83.34 -5.39 59.13 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -101.96 153.7 19.63 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -94.86 95.42 8.66 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 102.556 -3.128 . . . . 25.0 102.556 163.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.1 mt -67.06 -6.81 18.79 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -169.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.1 t -86.95 131.28 45.42 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.951 -0.759 . . . . 25.0 108.951 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -72.64 149.63 49.36 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 115.54 -2.506 . . . . 25.0 111.446 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -99.62 -12.07 20.39 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.151 0.426 . . . . 25.0 112.151 -177.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.7 m -147.47 65.86 1.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.366 -0.379 . . . . 25.0 110.357 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -88.99 135.87 33.32 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 118.458 -1.297 . . . . 25.0 109.176 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -123.19 99.13 6.2 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 103.406 -2.813 . . . . 25.0 103.406 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -91.83 92.06 8.2 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 106.535 -1.654 . . . . 25.0 106.535 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -109.91 119.32 38.97 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 107.984 -1.117 . . . . 25.0 107.984 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.64 77.94 0.82 Allowed Glycine 0 CA--C 1.503 -0.713 0 CA-C-N 115.33 -0.85 . . . . 25.0 113.844 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.98 23.56 6.39 Favored Glycine 0 C--N 1.32 -0.306 0 C-N-CA 120.899 -0.667 . . . . 25.0 114.08 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.06 105.89 4.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.792 0.806 . . . . 25.0 110.005 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 87.7 mt -69.97 127.06 92.67 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 106.596 -1.631 . . . . 25.0 106.596 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.17 169.73 21.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 N-CA-C 113.998 0.73 . . . . 25.0 113.998 -176.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.469 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.89 30.86 4.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.784 -1.191 . . . . 25.0 107.784 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.61 -21.02 0.22 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.997 1.719 . . . . 25.0 111.969 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.469 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.7 mt-30 -126.64 156.56 40.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 104.219 -2.512 . . . . 25.0 104.219 169.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -138.96 95.07 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.134 -2.173 . . . . 25.0 105.134 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.7 t -87.84 139.98 29.97 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.936 -2.616 . . . . 25.0 103.936 174.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -152.62 166.93 30.55 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 113.883 -1.508 . . . . 25.0 108.779 -175.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -135.44 155.89 49.8 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.058 -1.83 . . . . 25.0 106.058 174.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.06 161.32 25.27 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.019 -1.474 . . . . 25.0 107.019 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -105.89 118.65 37.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.992 0.182 . . . . 25.0 110.868 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.2 131.9 61.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -61.99 147.2 95.62 Favored 'Trans proline' 0 C--N 1.353 0.784 0 CA-C-O 121.615 0.59 . . . . 25.0 113.456 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.75 -25.69 35.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 25.0 112.526 -169.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -83.58 9.74 10.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.684 0.754 . . . . 25.0 110.192 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.99 52.97 0.88 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.4 p -86.0 166.92 15.51 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.983 -1.488 . . . . 25.0 106.983 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.74 -166.76 34.43 Favored Glycine 0 C--O 1.238 0.389 0 N-CA-C 115.926 1.131 . . . . 25.0 115.926 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.0 t -86.01 107.6 17.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.436 0.636 . . . . 25.0 110.813 -168.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -157.93 171.27 20.56 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.774 -0.648 . . . . 25.0 110.871 -176.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.57 149.98 7.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.64 -1.245 . . . . 25.0 107.64 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.99 127.71 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 101.665 -3.458 . . . . 25.0 101.665 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.92 132.0 56.81 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.711 -0.477 . . . . 25.0 109.711 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -110.92 128.69 55.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.6 p -122.29 137.93 54.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.991 0.9 . . . . 25.0 111.014 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.4 t90 -115.71 116.19 27.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.783 -1.553 . . . . 25.0 107.008 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.3 126.91 40.93 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.959 -1.126 . . . . 25.0 107.959 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 18.8 mm -82.6 140.96 15.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.19 -43.07 29.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.824 0.738 . . . . 25.0 110.014 176.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.36 -23.59 64.7 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 114.092 1.145 . . . . 25.0 114.092 -172.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.4 p -138.78 169.76 17.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.993 0.901 . . . . 25.0 110.118 -174.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.28 19.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.142 -0.935 . . . . 25.0 112.491 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -90.04 146.99 23.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.852 0.686 . . . . 25.0 112.852 -176.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.03 141.74 15.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 104.576 -2.379 . . . . 25.0 104.576 170.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -146.39 134.79 21.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.262 0.467 . . . . 25.0 112.262 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -91.56 115.1 27.77 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.918 0.762 . . . . 25.0 110.808 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -97.05 108.1 20.76 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.446 -1.316 . . . . 25.0 107.446 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.38 139.99 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.377 -0.829 . . . . 25.0 111.757 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 132.86 70.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 105.311 -2.107 . . . . 25.0 105.311 167.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -94.02 130.41 40.16 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.981 -1.489 . . . . 25.0 106.981 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.4 m -131.81 161.35 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.912 0.708 . . . . 25.0 112.912 -175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -117.71 95.0 4.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 103.654 -2.721 . . . . 25.0 103.654 166.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.93 161.27 16.0 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.086 0.47 . . . . 25.0 111.825 -171.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.2 p -145.86 164.29 32.41 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.815 -0.809 . . . . 25.0 108.815 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.707 0 CA-C-O 118.041 -0.98 . . . . 25.0 110.378 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.9 m80 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.246 0.546 . . . . 25.0 110.372 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.41 177.53 35.51 Favored Glycine 0 CA--C 1.508 -0.348 1 N-CA-C 101.717 -4.553 . . . . 25.0 101.717 -176.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -148.16 165.82 29.74 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.019 1.91 . . . . 25.0 109.414 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -100.59 122.43 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 106.481 -1.674 . . . . 25.0 106.481 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.24 -43.21 52.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.708 -1.133 . . . . 25.0 109.859 -173.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.69 129.76 5.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.194 -1.78 . . . . 25.0 106.194 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.43 130.83 10.69 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.89 0.788 . . . . 25.0 111.386 -0.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.21 113.4 5.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.985 -0.552 . . . . 25.0 112.334 -172.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -72.1 158.23 36.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.038 -0.727 . . . . 25.0 109.038 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -55.32 -25.23 33.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.387 0.675 . . . . 25.0 112.02 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.35 36.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.782 0.801 . . . . 25.0 109.455 176.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -67.61 -35.7 79.44 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.456 -0.793 . . . . 25.0 110.301 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -63.6 -33.18 75.04 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 120.97 -0.292 . . . . 25.0 110.759 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -40.31 96.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.257 0.551 . . . . 25.0 110.092 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -68.14 -35.4 78.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.28 0.562 . . . . 25.0 110.071 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.88 4.43 9.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.098 -0.501 . . . . 25.0 111.518 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 58.75 23.69 11.43 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.22 1.408 . . . . 25.0 112.851 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.436 ' C ' HD21 ' A' ' 19' ' ' ASN . 87.8 mt -87.89 -22.43 24.4 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.611 -1.255 . . . . 25.0 107.611 174.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.436 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.62 159.34 29.48 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 105.316 -2.105 . . . . 25.0 105.316 177.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -135.36 175.23 9.78 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.352 -0.24 . . . . 25.0 110.352 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 70.32 5.4 5.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.783 1.771 . . . . 25.0 115.783 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.47 -34.44 77.94 Favored 'General case' 0 CA--C 1.497 -1.059 0 O-C-N 121.375 -0.828 . . . . 25.0 110.359 172.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.36 -64.14 1.38 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.9 0.75 . . . . 25.0 112.153 179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.9 t -87.98 -53.41 4.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 122.539 1.162 . . . . 25.0 111.633 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.18 -10.73 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 114.523 -1.217 . . . . 25.0 113.233 -171.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -85.5 -3.53 58.89 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.917 -0.489 . . . . 25.0 111.13 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -115.66 -34.09 4.97 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.407 -0.517 . . . . 25.0 110.005 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -126.94 98.81 29.94 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 120.672 0.273 . . . . 25.0 110.798 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -76.92 -20.77 12.92 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 117.619 -1.121 . . . . 25.0 114.312 -174.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -82.27 9.06 9.56 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.211 0.449 . . . . 25.0 112.211 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -64.94 -23.2 67.15 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.15 0.796 . . . . 25.0 113.15 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.06 122.95 15.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 115.226 1.565 . . . . 25.0 115.226 -172.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.93 159.1 42.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 105.778 -1.934 . . . . 25.0 105.778 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.15 -168.58 23.23 Favored Glycine 0 N--CA 1.454 -0.156 0 N-CA-C 108.879 -1.689 . . . . 25.0 108.879 -177.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.4 tp -115.11 147.36 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.241 1.021 . . . . 25.0 112.062 -177.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -65.56 157.03 30.84 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.033 -0.729 . . . . 25.0 109.033 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.57 0.14 2.38 Favored Glycine 0 C--O 1.222 -0.646 0 CA-C-N 114.504 -1.225 . . . . 25.0 113.732 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -75.87 138.36 69.57 Favored Pre-proline 0 C--N 1.322 -0.628 0 O-C-N 121.402 -1.057 . . . . 25.0 110.815 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -92.77 -14.73 18.69 Favored 'Cis proline' 0 CA--C 1.544 0.98 0 C-N-CA 130.259 1.358 . . . . 25.0 115.385 -7.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -69.38 -35.62 76.0 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.162 1.541 . . . . 25.0 115.162 -168.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.97 34.1 4.94 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 105.846 -1.909 . . . . 25.0 105.846 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.78 -170.75 40.36 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.489 -1.232 . . . . 25.0 111.748 -176.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -60.5 170.39 4.34 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.994 2.462 . . . . 25.0 113.104 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 159.84 31.2 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.729 -1.582 . . . . 25.0 106.729 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -61.75 140.26 58.23 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.43 85.6 Favored Glycine 0 N--CA 1.453 -0.206 0 CA-C-N 115.782 -0.645 . . . . 25.0 112.373 -174.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -125.85 12.75 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.954 -0.387 . . . . 25.0 109.954 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.45 -52.87 46.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.122 -0.361 . . . . 25.0 111.824 -173.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.15 -20.04 59.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.889 -0.507 . . . . 25.0 109.969 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 p -83.24 -9.43 59.14 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.889 -0.325 . . . . 25.0 111.826 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.07 34.21 13.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.822 0.849 . . . . 25.0 110.342 -172.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.07 37.33 24.29 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.666 1.358 . . . . 25.0 114.666 -177.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.95 134.7 55.3 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.039 0.536 . . . . 25.0 110.891 175.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 p -62.27 -33.88 75.48 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 115.19 1.552 . . . . 25.0 115.19 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 t -70.67 -8.22 50.33 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.145 0.498 . . . . 25.0 112.296 -178.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 59' ' ' LEU . 12.9 m-85 -120.5 15.83 12.06 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 107.544 -1.28 . . . . 25.0 107.544 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -70.4 -40.48 73.87 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.146 -0.971 . . . . 25.0 111.739 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.59 -15.35 63.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.91 0.862 . . . . 25.0 109.942 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.65 -6.55 59.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.73 -0.841 . . . . 25.0 108.73 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -112.28 -33.73 6.12 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.236 0.828 . . . . 25.0 113.236 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -96.21 119.41 34.64 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 121.424 -0.798 . . . . 25.0 110.907 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -125.94 161.03 28.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.971 -1.013 . . . . 25.0 109.919 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 53.8 p -116.13 160.66 34.73 Favored Pre-proline 0 C--N 1.319 -0.747 1 N-CA-C 99.857 -4.127 . . . . 25.0 99.857 160.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -70.37 -0.49 7.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 116.995 -1.537 . . . . 25.0 115.794 -174.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.93 10.02 8.83 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.108 0.48 . . . . 25.0 111.471 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -78.49 -29.28 46.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.888 0.699 . . . . 25.0 112.888 -176.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.492 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 5.6 m95 -126.65 165.55 19.0 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.856 -0.424 . . . . 25.0 109.856 -179.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -67.22 131.4 45.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -100.03 105.45 17.12 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 101.325 -3.583 . . . . 25.0 101.325 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.7 136.25 52.6 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.929 -1.032 . . . . 25.0 111.057 -177.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -87.79 106.75 18.28 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.948 -1.024 . . . . 25.0 109.051 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.1 mt -132.38 173.73 10.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 157.94 23.32 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.768 -0.651 . . . . 25.0 110.843 -174.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.8 p -77.06 169.8 17.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.099 -1.445 . . . . 25.0 107.099 172.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 89.82 -160.35 28.67 Favored Glycine 0 C--O 1.239 0.439 0 N-CA-C 110.602 -0.999 . . . . 25.0 110.602 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.27 132.32 45.99 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 119.087 1.443 . . . . 25.0 114.218 -177.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.88 161.43 36.65 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.281 -1.748 . . . . 25.0 106.281 178.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 p -104.35 151.15 23.81 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.616 -1.254 . . . . 25.0 107.616 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -139.31 100.95 4.13 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.83 115.04 29.82 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 122.169 0.985 . . . . 25.0 109.483 -179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.7 m95 -101.17 148.43 25.1 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.964 -1.016 . . . . 25.0 109.701 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.9 111.1 13.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.215 -2.143 . . . . 25.0 105.215 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.73 128.49 56.44 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.619 0.768 . . . . 25.0 111.73 -173.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -32.61 23.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.315 0.579 . . . . 25.0 109.623 174.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.4 122.01 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.842 0.353 . . . . 25.0 110.54 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -82.59 3.33 29.15 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.78 152.98 44.47 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.653 -0.419 . . . . 25.0 109.997 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -68.99 156.0 39.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 114.308 1.225 . . . . 25.0 114.308 -171.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.412 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 13.4 t -96.88 159.78 14.73 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.181 -1.044 . . . . 25.0 108.181 173.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.9 t -117.86 -16.13 9.97 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 123.143 0.277 . . . . 25.0 110.442 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.53 160.2 4.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.207 0.527 . . . . 25.0 112.224 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -128.48 134.93 48.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.071 -2.566 . . . . 25.0 104.071 168.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -140.34 150.05 43.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.873 -0.788 . . . . 25.0 108.873 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.94 138.14 38.67 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.641 -1.614 . . . . 25.0 106.641 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -149.62 161.57 41.9 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.545 0.611 . . . . 25.0 110.305 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.96 163.29 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 114.014 1.116 . . . . 25.0 114.014 -169.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 21.9 p -77.73 164.19 25.48 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.238 -1.023 . . . . 25.0 108.238 171.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -64.3 159.75 55.65 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 107.838 -1.171 . . . . 25.0 107.838 176.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -68.57 -26.37 33.9 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 115.921 -2.253 . . . . 25.0 113.983 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -114.08 32.01 6.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.881 0.473 . . . . 25.0 111.037 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.496 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -68.39 168.85 11.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.05 0.929 . . . . 25.0 112.91 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -83.17 100.97 10.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.602 -1.181 . . . . 25.0 109.461 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.496 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -92.86 8.9 37.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.895 1.813 . . . . 25.0 115.895 -169.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.4 t -125.62 13.69 8.09 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.644 -0.872 . . . . 25.0 108.644 177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -116.94 158.61 43.57 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.281 -1.327 . . . . 25.0 107.677 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -65.69 152.7 80.93 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 118.22 -0.72 . . . . 25.0 111.248 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mp -69.53 101.97 1.72 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.786 0.661 . . . . 25.0 112.786 -175.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.3 p -95.44 153.75 17.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.876 -1.157 . . . . 25.0 107.876 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -64.13 -24.51 67.72 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.065 0.459 . . . . 25.0 111.559 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.4 -26.79 67.41 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 25.0 112.415 177.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -80.59 -6.57 58.48 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.598 0.592 . . . . 25.0 112.598 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.44 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 50.5 m-85 -105.41 157.51 17.3 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -175.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.14 96.25 7.98 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 102.606 -3.109 . . . . 25.0 102.606 162.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.98 -6.82 24.24 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.938 1.459 . . . . 25.0 114.938 -169.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.4 t -79.88 133.47 58.34 Favored Pre-proline 0 C--N 1.321 -0.635 0 N-CA-C 108.995 -0.742 . . . . 25.0 108.995 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -72.37 148.38 48.73 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 114.824 -2.984 . . . . 25.0 110.596 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -102.67 -8.32 21.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.032 0.444 . . . . 25.0 111.277 -179.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.23 68.86 1.04 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.962 -0.563 . . . . 25.0 109.894 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -88.93 129.39 35.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 119.488 -0.885 . . . . 25.0 108.931 177.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -121.45 98.98 6.22 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 104.272 -2.492 . . . . 25.0 104.272 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -90.99 92.01 8.57 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.014 -1.106 . . . . 25.0 108.014 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -110.77 117.42 33.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.994 -1.484 . . . . 25.0 106.994 175.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.18 82.72 0.35 Allowed Glycine 0 CA--C 1.501 -0.819 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.717 -170.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 122.64 13.19 4.74 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 120.98 -0.628 . . . . 25.0 113.812 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.28 104.04 5.69 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.7 mt -74.76 122.83 88.35 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.51 156.8 49.61 Favored 'Trans proline' 0 C--N 1.345 0.389 0 N-CA-C 114.503 0.924 . . . . 25.0 114.503 -176.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -99.14 29.39 3.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 73.56 -15.89 0.53 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.881 1.673 . . . . 25.0 112.601 -176.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -130.55 148.97 52.41 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.5 t -142.48 94.96 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 106.996 -1.483 . . . . 25.0 106.996 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.1 t -88.71 136.89 32.77 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.9 166.94 23.27 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 106.12 -1.807 . . . . 25.0 106.12 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -133.46 152.87 51.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.415 -2.069 . . . . 25.0 105.415 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.65 159.54 33.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.795 -1.187 . . . . 25.0 107.795 -178.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -105.29 115.52 30.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.737 0.273 . . . . 25.0 111.737 -175.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.79 132.6 64.03 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 108.753 -0.832 . . . . 25.0 108.753 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -61.66 146.81 96.51 Favored 'Trans proline' 0 C--N 1.354 0.864 0 N-CA-C 113.682 0.609 . . . . 25.0 113.682 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.57 -29.56 41.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.98 -168.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -81.88 7.07 13.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.584 -0.735 . . . . 25.0 110.594 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.1 mmt-85 -114.03 51.9 0.85 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.027 -1.101 . . . . 25.0 108.027 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.09 170.96 11.73 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.557 -1.645 . . . . 25.0 106.557 175.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 86.89 -167.37 38.17 Favored Glycine 0 C--N 1.321 -0.263 0 N-CA-C 116.213 1.245 . . . . 25.0 116.213 176.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.4 t -86.03 106.91 17.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.41 0.624 . . . . 25.0 110.985 -168.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -158.2 171.25 20.54 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.907 -0.588 . . . . 25.0 111.623 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -105.7 150.22 8.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 64.2 mt -131.94 122.84 50.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -106.88 132.96 52.24 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.192 -0.913 . . . . 25.0 109.998 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.4 137.73 54.43 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 122.905 0.482 . . . . 25.0 109.76 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.6 p -128.8 138.0 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 114.04 1.126 . . . . 25.0 114.04 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.412 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.3 t90 -98.44 121.6 40.59 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 105.086 -2.191 . . . . 25.0 105.086 170.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -106.17 119.35 39.01 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.815 -1.18 . . . . 25.0 107.815 -176.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 22.2 mm -84.71 137.97 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 122.031 -0.418 . . . . 25.0 112.092 -171.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -77.9 -45.12 25.01 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.57 -0.706 . . . . 25.0 111.094 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.22 -25.9 65.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.697 1.369 . . . . 25.0 114.697 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 69.6 p -139.31 165.9 25.96 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.444 0.64 . . . . 25.0 109.607 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.62 29.84 0.25 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.555 -0.748 . . . . 25.0 112.642 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -99.05 147.94 24.53 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -177.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.32 144.94 12.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 171.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -146.75 130.62 17.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.996 0.369 . . . . 25.0 111.996 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -91.7 118.08 30.34 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.527 0.517 . . . . 25.0 110.776 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -97.17 116.74 29.93 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.875 -1.158 . . . . 25.0 107.875 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.82 140.16 29.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.951 -0.568 . . . . 25.0 112.117 -176.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -126.93 134.31 66.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 105.945 -1.872 . . . . 25.0 105.945 167.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -94.08 130.43 40.24 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 176.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.1 m -132.06 162.8 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 113.08 0.77 . . . . 25.0 113.08 -174.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -118.06 95.11 4.76 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.78 163.9 14.29 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.008 -0.542 . . . . 25.0 112.109 -172.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 63.3 p -143.83 151.82 40.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.686 -0.487 . . . . 25.0 109.686 175.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.421 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 117.791 -1.099 . . . . 25.0 112.345 -176.117 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.496 0.665 . . . . 25.0 110.389 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 170.61 36.62 Favored Glycine 0 CA--C 1.508 -0.395 1 N-CA-C 101.375 -4.69 . . . . 25.0 101.375 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -147.85 164.78 32.6 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 120.402 2.101 . . . . 25.0 110.336 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -101.03 122.3 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 107.639 -1.245 . . . . 25.0 107.639 176.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.61 -42.36 61.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.72 -1.127 . . . . 25.0 109.974 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 t -153.34 129.5 5.36 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.76 133.81 17.78 Favored 'Cis proline' 0 CA--C 1.533 0.464 0 C-N-CA 128.791 0.746 . . . . 25.0 111.103 -0.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 110.49 3.21 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.576 0.584 . . . . 25.0 112.576 -172.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.2 t -71.94 157.17 38.33 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.2 mtp180 -55.42 -24.98 33.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.478 0.711 . . . . 25.0 112.272 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.76 -53.99 38.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.826 0.822 . . . . 25.0 109.539 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -68.26 -33.06 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.501 -0.772 . . . . 25.0 110.818 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.9 -33.17 74.74 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 122.009 -0.432 . . . . 25.0 110.449 177.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -65.59 -38.99 91.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.72 -0.474 . . . . 25.0 109.72 178.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -64.48 -36.75 85.21 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.202 0.525 . . . . 25.0 110.263 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -78.22 5.8 9.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.037 -0.528 . . . . 25.0 111.473 177.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 58.73 25.74 13.78 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.137 1.375 . . . . 25.0 112.751 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.466 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.1 mt -91.78 -18.88 23.22 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.466 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -122.35 158.25 30.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 177.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.9 p -133.93 175.23 9.65 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 122.866 0.466 . . . . 25.0 109.956 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 68.12 5.29 4.55 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.848 1.796 . . . . 25.0 115.848 175.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.1 m -68.66 -35.37 77.15 Favored 'General case' 0 CA--C 1.504 -0.811 0 O-C-N 121.601 -0.687 . . . . 25.0 112.025 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.42 -62.96 1.83 Allowed Glycine 0 C--O 1.22 -0.743 0 O-C-N 123.813 0.695 . . . . 25.0 111.804 -177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -88.01 -50.1 6.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 114.74 1.385 . . . . 25.0 114.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.08 -13.07 14.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 114.549 -1.205 . . . . 25.0 114.146 -165.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -82.59 -9.97 59.17 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.24 -0.984 . . . . 25.0 111.563 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -105.99 -34.09 7.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.266 -0.574 . . . . 25.0 109.479 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -127.1 98.9 29.29 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.638 -0.255 . . . . 25.0 111.246 172.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.16 -21.58 20.2 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 117.281 -1.346 . . . . 25.0 113.907 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -87.97 15.26 7.49 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.193 0.442 . . . . 25.0 112.193 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.8 m -61.62 -25.27 67.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.973 0.416 . . . . 25.0 111.874 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.94 117.93 5.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 115.514 1.672 . . . . 25.0 115.514 -173.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -152.95 157.28 40.36 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 105.231 -2.137 . . . . 25.0 105.231 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.76 -164.79 16.32 Favored Glycine 0 CA--C 1.51 -0.278 0 N-CA-C 108.656 -1.778 . . . . 25.0 108.656 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -118.15 149.79 40.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.432 1.116 . . . . 25.0 112.6 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.88 156.99 31.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.012 -1.107 . . . . 25.0 108.012 171.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.55 -2.77 1.77 Allowed Glycine 0 C--O 1.225 -0.459 0 CA-C-N 114.671 -1.149 . . . . 25.0 113.418 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.69 140.68 71.53 Favored Pre-proline 0 C--N 1.323 -0.571 0 O-C-N 121.518 -0.99 . . . . 25.0 110.676 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -92.84 -14.15 19.83 Favored 'Cis proline' 0 CA--C 1.543 0.937 0 C-N-CA 130.195 1.331 . . . . 25.0 115.243 -7.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -71.79 -36.87 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.193 1.553 . . . . 25.0 115.193 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.17 34.07 5.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.5 -174.62 44.64 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 114.533 -1.212 . . . . 25.0 111.717 -176.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.53 172.67 1.9 Allowed 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 123.663 2.909 . . . . 25.0 112.85 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.16 159.96 30.99 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 106.858 -1.534 . . . . 25.0 106.858 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.04 140.76 55.41 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.097 -1.446 . . . . 25.0 107.097 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.23 -6.93 77.87 Favored Glycine 0 C--O 1.23 -0.114 0 C-N-CA 121.294 -0.479 . . . . 25.0 112.958 -174.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -124.89 9.68 8.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.376 -0.485 . . . . 25.0 109.847 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.9 mt -66.98 -50.75 61.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 122.044 -0.41 . . . . 25.0 111.405 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.06 -21.38 59.95 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.92 -0.488 . . . . 25.0 109.839 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.6 p -82.66 -9.46 59.37 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.844 -0.343 . . . . 25.0 111.821 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.29 37.61 19.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.721 0.808 . . . . 25.0 110.416 -172.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.6 t70 63.12 32.59 15.11 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.736 1.384 . . . . 25.0 114.736 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -118.97 134.54 55.12 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.785 -0.572 . . . . 25.0 111.973 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 p -62.82 -35.09 78.78 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 115.717 1.747 . . . . 25.0 115.717 -173.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.76 -8.03 49.33 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.254 0.549 . . . . 25.0 112.05 -178.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HA ' HD11 ' A' ' 59' ' ' LEU . 10.0 m-85 -121.38 14.71 11.23 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 107.734 -1.21 . . . . 25.0 107.734 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -69.16 -41.14 77.63 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.108 -0.995 . . . . 25.0 111.038 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -73.87 -11.25 60.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.913 0.863 . . . . 25.0 109.675 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 56' ' ' PHE . 3.0 mp -86.2 -3.43 58.97 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -114.48 -32.87 5.77 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.02 0.378 . . . . 25.0 112.02 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -97.46 120.66 38.23 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 121.477 -0.764 . . . . 25.0 110.299 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.422 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -125.83 160.97 28.46 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.316 -0.857 . . . . 25.0 109.684 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.5 p -114.99 161.19 30.53 Favored Pre-proline 0 C--N 1.318 -0.768 1 N-CA-C 99.58 -4.23 . . . . 25.0 99.58 160.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.57 -2.64 10.39 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 116.823 -1.651 . . . . 25.0 116.127 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -126.1 11.49 7.63 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.754 0.787 . . . . 25.0 111.282 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -79.59 -29.86 41.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.276 -0.89 . . . . 25.0 112.969 -176.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.422 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.1 m95 -125.6 167.01 15.68 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 110.022 -0.362 . . . . 25.0 110.022 -177.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -68.2 125.7 27.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 172.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -99.22 106.12 18.24 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 100.202 -3.999 . . . . 25.0 100.202 176.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.85 135.12 52.03 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.175 -0.92 . . . . 25.0 110.495 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -89.77 100.68 13.44 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.848 -1.167 . . . . 25.0 107.848 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.3 mt -131.28 174.03 10.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.244 -1.021 . . . . 25.0 108.244 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.67 155.6 24.19 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.478 -0.783 . . . . 25.0 111.666 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.2 p -77.28 167.21 22.1 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 172.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.97 -162.08 22.87 Favored Glycine 0 C--O 1.241 0.553 0 N-CA-C 110.712 -0.955 . . . . 25.0 110.712 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 133.87 56.65 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 118.958 1.379 . . . . 25.0 114.043 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.42 159.54 41.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.45 -1.685 . . . . 25.0 106.45 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.8 p -106.12 152.97 22.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 106.923 -1.51 . . . . 25.0 106.923 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -138.28 101.06 4.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 105.238 -2.134 . . . . 25.0 105.238 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.1 107.78 20.34 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.865 0.84 . . . . 25.0 110.114 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -97.21 146.47 25.06 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.426 -0.806 . . . . 25.0 110.074 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -124.89 112.11 16.24 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.67 108.5 17.98 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.437 -0.801 . . . . 25.0 111.225 -172.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -71.69 -32.73 68.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.443 0.639 . . . . 25.0 109.861 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.49 117.56 23.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.495 -0.557 . . . . 25.0 109.495 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -72.64 -5.73 39.46 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.654 1.353 . . . . 25.0 114.654 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.94 156.61 23.96 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -72.87 156.03 39.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 113.762 1.023 . . . . 25.0 113.762 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.427 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 12.4 t -99.96 157.67 16.37 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.527 -0.916 . . . . 25.0 108.527 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -118.12 -14.7 9.91 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.117 0.261 . . . . 25.0 111.617 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.7 t -172.58 152.66 2.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.849 0.356 . . . . 25.0 111.51 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 51.5 m95 -122.92 138.91 54.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 104.599 -2.371 . . . . 25.0 104.599 167.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -143.49 147.03 33.9 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -136.15 132.86 36.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.169 -1.789 . . . . 25.0 106.169 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.83 161.8 41.1 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.446 0.566 . . . . 25.0 110.197 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.29 165.96 30.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 113.427 0.899 . . . . 25.0 113.427 -167.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 17.0 p -80.36 160.3 25.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.49 -1.3 . . . . 25.0 107.49 169.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -61.89 159.41 36.3 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.29 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 -24.36 34.51 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 116.256 -2.029 . . . . 25.0 114.234 -173.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -114.43 32.05 6.21 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.398 . . . . 25.0 111.358 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.504 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -74.15 166.99 22.46 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.952 0.882 . . . . 25.0 112.87 -176.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -83.0 100.99 10.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.683 -1.144 . . . . 25.0 110.031 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.504 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.31 15.46 10.47 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 116.421 2.008 . . . . 25.0 116.421 -169.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.7 t -124.29 9.03 8.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.814 -0.81 . . . . 25.0 108.814 175.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -112.52 158.44 37.35 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 114.544 -1.207 . . . . 25.0 108.077 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.82 154.61 71.96 Favored 'Trans proline' 0 C--N 1.347 0.481 0 O-C-N 121.863 0.401 . . . . 25.0 111.953 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.05 105.14 3.8 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.364 0.602 . . . . 25.0 111.046 -177.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.6 p -94.04 154.43 17.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -63.59 -26.58 68.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.035 -0.415 . . . . 25.0 111.639 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.07 62.65 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.714 177.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.0 t -76.73 -20.79 56.13 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.627 0.727 . . . . 25.0 111.305 -178.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 55.8 m-85 -88.21 154.95 20.02 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 115.134 1.531 . . . . 25.0 115.134 -176.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -92.3 95.85 9.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 102.301 -3.222 . . . . 25.0 102.301 161.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 79.9 mt -66.96 -6.85 18.42 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.77 1.396 . . . . 25.0 114.77 -169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.0 t -85.97 130.35 50.71 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.314 -0.995 . . . . 25.0 108.314 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.93 148.99 52.55 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 115.509 -2.528 . . . . 25.0 111.457 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -100.07 -9.1 22.99 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.123 0.487 . . . . 25.0 111.266 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.0 m -149.23 69.48 1.06 Allowed 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.943 -0.571 . . . . 25.0 109.561 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -88.99 134.58 33.93 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.566 -0.854 . . . . 25.0 109.185 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.51 99.04 5.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 105.849 -1.908 . . . . 25.0 105.849 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -91.98 92.08 8.14 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -105.14 118.34 36.28 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 106.796 -1.557 . . . . 25.0 106.796 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.27 79.9 0.47 Allowed Glycine 0 CA--C 1.502 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 114.082 -167.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.84 22.44 6.63 Favored Glycine 0 C--N 1.32 -0.361 0 C-N-CA 120.861 -0.685 . . . . 25.0 112.61 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.27 105.68 5.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.415 0.626 . . . . 25.0 109.343 177.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.49 122.78 87.56 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 105.596 -2.001 . . . . 25.0 105.596 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.73 168.11 24.19 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 117.714 -1.057 . . . . 25.0 113.872 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.428 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -93.99 24.29 4.36 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.693 -0.855 . . . . 25.0 108.693 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.83 -17.97 0.28 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.843 1.657 . . . . 25.0 112.602 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.8 mt-30 -129.06 148.04 50.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 104.028 -2.582 . . . . 25.0 104.028 170.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.86 94.95 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.049 -1.463 . . . . 25.0 107.049 -178.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.4 m -85.71 100.06 11.74 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 107.894 -1.15 . . . . 25.0 107.894 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.08 166.53 11.55 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.303 -1.369 . . . . 25.0 107.303 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -134.64 153.58 51.91 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 170.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -164.38 160.59 20.93 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.922 -1.14 . . . . 25.0 107.922 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -105.21 117.26 33.56 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.172 0.295 . . . . 25.0 110.948 -176.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.14 130.95 67.77 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 107.924 -1.139 . . . . 25.0 107.924 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -62.2 147.31 95.26 Favored 'Trans proline' 0 C--N 1.353 0.793 0 CA-C-O 121.682 0.617 . . . . 25.0 113.402 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.11 -25.65 36.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.222 -0.899 . . . . 25.0 112.653 -169.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 p-10 -83.76 9.4 11.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.698 0.761 . . . . 25.0 110.225 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -115.13 53.3 0.83 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.189 -1.041 . . . . 25.0 108.189 171.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 32.3 p -86.11 166.69 15.6 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 106.414 -1.699 . . . . 25.0 106.414 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.16 -166.76 35.41 Favored Glycine 0 C--N 1.319 -0.384 0 N-CA-C 115.459 0.944 . . . . 25.0 115.459 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.01 108.31 18.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.488 0.661 . . . . 25.0 110.938 -168.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.9 p-80 -156.94 171.18 20.91 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.834 -0.621 . . . . 25.0 110.819 -176.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 p -107.8 150.6 10.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 49.8 mt -131.5 120.1 44.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.489 -2.041 . . . . 25.0 105.489 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.56 132.73 51.36 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.04 135.1 50.33 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.993 -0.373 . . . . 25.0 109.993 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.7 p -122.01 144.2 32.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 122.075 0.941 . . . . 25.0 112.572 -177.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.427 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.6 t90 -112.48 105.62 13.9 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.173 -2.158 . . . . 25.0 105.173 173.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.17 127.37 35.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.569 -1.271 . . . . 25.0 107.569 179.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.0 mm -83.62 140.68 15.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.768 -0.456 . . . . 25.0 109.768 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.38 -42.78 24.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.353 0.597 . . . . 25.0 110.477 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.13 -24.62 65.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.734 1.012 . . . . 25.0 113.734 -172.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.6 p -139.49 171.21 14.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.999 0.904 . . . . 25.0 110.206 -174.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.6 20.21 0.74 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.239 -0.891 . . . . 25.0 112.209 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -90.1 146.48 24.28 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.057 0.762 . . . . 25.0 113.057 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.06 144.61 11.48 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -147.95 127.19 12.98 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -84.34 117.13 23.4 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.04 0.448 . . . . 25.0 110.732 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -97.1 112.53 24.26 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.81 141.02 29.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.432 -0.804 . . . . 25.0 111.869 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.15 134.87 65.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 105.607 -1.997 . . . . 25.0 105.607 166.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -93.65 131.25 39.14 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.885 -1.524 . . . . 25.0 106.885 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.4 m -132.5 161.24 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.652 0.612 . . . . 25.0 112.652 -175.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.68 95.05 4.68 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 103.729 -2.693 . . . . 25.0 103.729 167.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.4 163.18 14.78 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 112.558 0.577 . . . . 25.0 112.558 -171.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 74.9 p -145.88 164.09 33.04 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.493 -0.929 . . . . 25.0 108.493 177.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.069 -0.967 . . . . 25.0 110.515 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.0 m80 . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.356 0.598 . . . . 25.0 110.473 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.22 169.58 35.84 Favored Glycine 0 C--N 1.32 -0.348 1 N-CA-C 101.077 -4.809 . . . . 25.0 101.077 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.456 ' HA ' HE22 ' A' ' 162' ' ' GLN . 36.7 p90 -143.97 165.71 27.0 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 120.124 1.962 . . . . 25.0 110.2 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -102.46 121.23 53.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 106.17 -1.789 . . . . 25.0 106.17 176.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -74.04 -41.43 61.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.53 -1.213 . . . . 25.0 109.553 -174.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -154.17 129.22 4.97 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 105.987 -1.857 . . . . 25.0 105.987 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -65.28 131.56 13.29 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 128.828 0.761 . . . . 25.0 111.543 -0.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 113.15 4.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.996 -0.547 . . . . 25.0 111.594 -173.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.4 p -72.13 163.71 27.44 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.273 -0.639 . . . . 25.0 109.273 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -59.73 -21.86 61.25 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.146 0.498 . . . . 25.0 111.797 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.28 -53.68 27.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.934 -0.765 . . . . 25.0 108.934 174.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.01 -35.81 81.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.684 -0.689 . . . . 25.0 110.759 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.41 -32.62 74.32 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.13 -0.356 . . . . 25.0 111.024 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 25.0 109.839 177.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -66.77 -36.09 81.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.141 0.496 . . . . 25.0 109.864 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.97 3.61 11.84 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.357 -0.383 . . . . 25.0 111.964 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 58.53 21.84 9.03 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.094 1.357 . . . . 25.0 112.836 -178.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.458 ' C ' HD21 ' A' ' 19' ' ' ASN . 95.5 mt -84.72 -21.17 30.19 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.284 -1.376 . . . . 25.0 107.284 173.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.458 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -123.19 157.73 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 104.736 -2.32 . . . . 25.0 104.736 176.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 p -135.26 176.67 8.46 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.575 -0.528 . . . . 25.0 109.575 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 69.83 5.05 5.04 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.536 1.68 . . . . 25.0 115.536 174.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -68.06 -38.84 82.91 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 121.402 -0.811 . . . . 25.0 110.844 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.32 -63.81 1.74 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.683 0.614 . . . . 25.0 112.037 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -87.97 -52.45 5.26 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 122.503 1.144 . . . . 25.0 111.889 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.86 -11.82 14.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.469 -1.241 . . . . 25.0 113.248 -171.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -85.6 -1.44 57.13 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 121.739 -0.601 . . . . 25.0 111.487 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.41 -34.08 4.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.056 -0.657 . . . . 25.0 110.349 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -127.04 95.79 35.99 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 120.7 0.286 . . . . 25.0 110.349 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.63 -19.39 32.04 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 115.05 1.134 . . . . 25.0 115.05 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -87.02 10.92 14.96 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.772 -0.58 . . . . 25.0 112.404 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.9 m -62.52 -18.29 61.64 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.559 0.577 . . . . 25.0 112.559 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.1 m -64.13 122.35 14.86 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 114.875 1.435 . . . . 25.0 114.875 -175.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -153.04 155.23 36.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.601 -1.629 . . . . 25.0 106.601 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.62 -167.09 19.77 Favored Glycine 0 CA--C 1.512 -0.123 0 N-CA-C 107.838 -2.105 . . . . 25.0 107.838 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 tp -117.93 149.77 40.35 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.536 1.168 . . . . 25.0 111.891 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -65.02 156.93 29.81 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.36 -1.348 . . . . 25.0 107.36 171.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.89 4.57 2.98 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-N 114.848 -1.069 . . . . 25.0 113.73 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -75.99 143.22 73.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 121.528 -0.983 . . . . 25.0 109.263 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.22 -16.93 17.24 Favored 'Cis proline' 0 CA--C 1.543 0.934 0 N-CA-C 115.635 1.36 . . . . 25.0 115.635 -5.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -70.85 -37.75 73.15 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.95 1.463 . . . . 25.0 114.95 -169.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -113.26 28.47 8.76 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.067 -1.827 . . . . 25.0 106.067 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.09 -176.43 45.06 Favored Glycine 0 N--CA 1.445 -0.702 0 CA-C-N 114.567 -1.197 . . . . 25.0 110.692 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.59 175.17 1.77 Allowed 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 123.781 2.987 . . . . 25.0 113.222 177.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.04 160.03 31.01 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.683 -1.599 . . . . 25.0 106.683 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.25 140.07 57.23 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 175.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.33 -5.9 83.26 Favored Glycine 0 C--O 1.229 -0.212 0 CA-C-O 121.349 0.416 . . . . 25.0 112.785 -174.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 60.1 m170 -125.76 8.88 7.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.453 -0.44 . . . . 25.0 110.962 178.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.8 mt -64.52 -46.8 91.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 121.915 -0.491 . . . . 25.0 110.968 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.39 -12.09 59.98 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.078 -0.389 . . . . 25.0 110.482 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 p -94.0 -7.58 42.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.01 33.97 12.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.555 0.742 . . . . 25.0 110.758 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.38 32.55 19.06 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.339 1.237 . . . . 25.0 114.339 -178.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -118.46 137.61 53.05 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.124 0.488 . . . . 25.0 111.608 176.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.85 -34.88 78.27 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 115.233 1.568 . . . . 25.0 115.233 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.5 t -71.46 -7.41 47.26 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.27 0.557 . . . . 25.0 112.468 -177.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.407 ' HA ' ' CD1' ' A' ' 59' ' ' LEU . 16.3 m-85 -120.37 12.5 11.69 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 107.161 -1.422 . . . . 25.0 107.161 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -72.12 -35.08 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.081 -1.012 . . . . 25.0 110.171 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mp0 -70.08 -16.56 63.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.897 0.856 . . . . 25.0 109.864 175.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.407 ' CD1' ' HA ' ' A' ' 56' ' ' PHE . 1.3 mp -87.42 -5.93 58.64 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 -176.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -114.14 -31.96 6.16 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 112.384 0.513 . . . . 25.0 112.384 174.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -95.1 118.15 31.41 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.539 -0.726 . . . . 25.0 110.342 -178.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.442 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -126.38 161.01 28.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.109 -0.701 . . . . 25.0 109.109 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.1 p -118.81 161.6 35.28 Favored Pre-proline 0 C--N 1.317 -0.813 0 N-CA-C 100.245 -3.983 . . . . 25.0 100.245 162.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.4 -5.09 15.13 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 116.728 -1.715 . . . . 25.0 115.588 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.4 t -123.66 10.03 9.0 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.063 0.459 . . . . 25.0 111.71 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -79.07 -30.46 43.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.724 0.638 . . . . 25.0 112.724 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 14.5 m95 -123.51 165.78 16.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 120.698 0.285 . . . . 25.0 110.516 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -67.72 129.17 39.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 105.471 -2.048 . . . . 25.0 105.471 169.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -100.15 105.84 17.49 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 101.249 -3.612 . . . . 25.0 101.249 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.75 135.79 54.51 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.819 -1.082 . . . . 25.0 109.93 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -93.43 106.17 18.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.826 -1.079 . . . . 25.0 109.091 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -131.64 173.71 10.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.655 -1.239 . . . . 25.0 107.655 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.73 157.34 23.32 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.727 -0.669 . . . . 25.0 110.421 -176.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 66.8 p -77.28 166.76 22.77 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.921 -1.511 . . . . 25.0 106.921 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.52 -161.78 23.18 Favored Glycine 0 C--O 1.241 0.539 0 N-CA-C 110.336 -1.106 . . . . 25.0 110.336 -177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.23 132.54 47.33 Favored 'Trans proline' 0 C--N 1.346 0.408 0 CA-C-N 119.147 1.473 . . . . 25.0 114.288 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -138.93 161.31 37.64 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.1 p -103.43 150.91 23.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -138.15 100.92 4.27 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.467 -2.049 . . . . 25.0 105.467 -178.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.78 116.13 31.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 122.041 0.924 . . . . 25.0 110.023 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -100.48 149.2 23.93 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.151 -0.931 . . . . 25.0 109.85 178.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -127.92 115.05 17.96 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.494 -2.409 . . . . 25.0 104.494 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -114.37 121.93 45.13 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.101 -0.954 . . . . 25.0 110.791 -172.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.4 t -74.48 -29.72 61.55 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.51 0.671 . . . . 25.0 110.141 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.62 133.38 35.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.03 0.443 . . . . 25.0 110.856 -177.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -77.92 -5.77 52.18 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.748 0.648 . . . . 25.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -63.97 156.86 26.6 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.353 0.872 . . . . 25.0 113.353 -175.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.4 t -77.63 155.97 31.08 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.561 1.319 . . . . 25.0 114.561 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -103.67 156.23 17.95 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.024 -0.535 . . . . 25.0 109.711 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -118.03 -14.81 9.96 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.227 0.454 . . . . 25.0 112.227 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.4 t -172.54 154.1 3.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.976 0.417 . . . . 25.0 111.525 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.3 m95 -128.06 134.73 49.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.83 -2.285 . . . . 25.0 104.83 168.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -141.0 149.61 41.99 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.373 -0.973 . . . . 25.0 108.373 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -137.95 135.29 35.89 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 105.731 -1.951 . . . . 25.0 105.731 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.98 160.9 42.88 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.183 0.447 . . . . 25.0 109.938 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.35 166.5 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 112.736 0.643 . . . . 25.0 112.736 -167.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 p -79.6 158.7 27.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -62.32 158.91 44.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.109 -0.95 . . . . 25.0 109.859 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.52 -15.64 38.11 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 117.894 -0.937 . . . . 25.0 114.179 -174.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -118.66 32.06 6.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.721 0.408 . . . . 25.0 111.882 -176.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.538 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -79.14 161.58 26.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.819 0.819 . . . . 25.0 112.076 -177.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -83.11 101.03 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.703 -1.135 . . . . 25.0 110.098 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.538 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -83.98 16.68 2.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 116.928 2.195 . . . . 25.0 116.928 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -123.87 5.16 8.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.587 0.708 . . . . 25.0 109.179 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -108.71 157.45 36.68 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 114.838 -1.074 . . . . 25.0 108.499 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.71 154.9 70.08 Favored 'Trans proline' 0 C--N 1.346 0.415 0 O-C-N 121.968 0.457 . . . . 25.0 112.695 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.26 112.25 9.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.321 0.581 . . . . 25.0 110.945 -177.028 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.8 p -104.7 156.8 17.66 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -63.82 -27.04 68.9 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 122.087 -0.383 . . . . 25.0 111.735 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -25.16 61.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.91 -0.586 . . . . 25.0 112.075 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.2 t -78.29 -20.43 51.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.177 0.513 . . . . 25.0 111.149 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -89.78 153.86 20.36 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 115.077 1.51 . . . . 25.0 115.077 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -90.8 97.93 11.47 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 103.133 -2.914 . . . . 25.0 103.133 162.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -67.46 -5.87 16.86 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.82 1.415 . . . . 25.0 114.82 -170.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -88.44 128.64 52.27 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.206 -1.035 . . . . 25.0 108.206 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.04 145.73 50.5 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.325 -2.65 . . . . 25.0 111.422 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -95.17 -9.13 34.32 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.916 0.389 . . . . 25.0 111.788 -177.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 55.6 m -151.39 69.35 0.94 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.082 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.15 133.57 34.35 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 118.775 -1.17 . . . . 25.0 109.858 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.36 99.06 6.27 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -93.26 92.07 7.54 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 107.229 -1.397 . . . . 25.0 107.229 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -108.81 118.36 36.6 Favored 'General case' 0 C--O 1.216 -0.675 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 178.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -93.61 76.63 1.09 Allowed Glycine 0 CA--C 1.503 -0.705 0 CA-C-N 115.434 -0.803 . . . . 25.0 114.772 -168.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 105.11 25.34 6.79 Favored Glycine 0 C--N 1.319 -0.388 0 C-N-CA 121.011 -0.614 . . . . 25.0 113.122 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.89 106.35 3.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.649 0.738 . . . . 25.0 109.724 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.05 123.72 88.8 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 106.712 -1.588 . . . . 25.0 106.712 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.33 172.41 15.4 Favored 'Trans proline' 0 C--N 1.344 0.327 0 N-CA-C 113.887 0.687 . . . . 25.0 113.887 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.447 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -99.53 27.68 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.017 -1.105 . . . . 25.0 108.017 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.24 -9.84 0.58 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.622 1.569 . . . . 25.0 112.129 -173.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.447 ' H ' ' C ' ' A' ' 128' ' ' ALA . 60.8 mt-30 -131.48 151.65 51.39 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 103.849 -2.649 . . . . 25.0 103.849 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -142.1 95.18 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 106.924 -1.51 . . . . 25.0 106.924 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.5 t -94.37 126.88 39.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 107.179 -1.415 . . . . 25.0 107.179 175.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -133.17 166.92 21.33 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 105.299 -2.111 . . . . 25.0 105.299 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -131.33 151.07 51.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 173.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.07 158.95 37.39 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.791 -1.189 . . . . 25.0 107.791 -177.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -102.21 116.17 32.1 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.091 0.245 . . . . 25.0 111.15 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.8 mt -76.91 131.26 73.65 Favored Pre-proline 0 C--O 1.241 0.606 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.37 146.41 97.26 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-O 121.655 0.606 . . . . 25.0 113.527 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.01 -26.24 36.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.186 -0.915 . . . . 25.0 112.588 -168.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -84.31 10.78 9.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 25.0 110.172 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.5 mmt-85 -116.15 50.65 1.02 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.45 -0.944 . . . . 25.0 108.45 171.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.0 p -85.86 164.63 17.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.491 -1.3 . . . . 25.0 107.491 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.69 -166.91 31.81 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 114.648 0.619 . . . . 25.0 114.648 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.3 t -86.02 112.43 21.22 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.353 0.596 . . . . 25.0 110.354 -169.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -159.46 172.27 18.2 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.711 -0.677 . . . . 25.0 110.317 -176.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.07 151.69 10.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.3 mt -133.13 122.32 45.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 104.895 -2.261 . . . . 25.0 104.895 -178.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.41 134.55 50.3 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.557 -0.747 . . . . 25.0 109.919 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -125.12 134.44 52.45 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.791 0.436 . . . . 25.0 110.078 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.21 142.91 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 122.322 1.058 . . . . 25.0 112.438 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -111.49 114.58 27.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 105.737 -1.949 . . . . 25.0 105.737 173.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -94.69 122.31 37.16 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.842 -1.17 . . . . 25.0 107.842 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.5 mm -78.69 142.42 14.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.543 -0.54 . . . . 25.0 109.543 -177.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.54 -42.94 21.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.924 0.784 . . . . 25.0 110.108 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -23.89 64.79 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.649 0.981 . . . . 25.0 113.649 -172.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.3 p -139.09 168.61 19.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.901 0.858 . . . . 25.0 109.988 -175.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.24 21.39 0.75 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.285 -0.871 . . . . 25.0 112.334 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -90.7 147.27 23.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.35 143.41 11.94 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 105.916 -1.883 . . . . 25.0 105.916 173.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -148.07 128.54 14.02 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.72 0.267 . . . . 25.0 111.72 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -86.96 117.76 25.9 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 120.74 0.305 . . . . 25.0 110.859 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . 0.456 HE22 ' HA ' ' A' ' 3' ' ' TYR . 78.0 mt-30 -97.24 118.7 34.27 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 176.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -87.89 142.5 27.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.713 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.85 134.85 65.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 105.298 -2.112 . . . . 25.0 105.298 166.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.71 129.54 42.89 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 177.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -132.97 162.11 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 113.454 0.909 . . . . 25.0 113.454 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -117.89 95.11 4.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 104.56 -2.385 . . . . 25.0 104.56 168.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.14 163.66 14.76 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 112.397 0.517 . . . . 25.0 112.397 -173.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.3 p -145.74 162.95 36.42 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.896 -1.15 . . . . 25.0 107.896 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.443 ' C ' ' HZ1' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 117.96 -1.019 . . . . 25.0 110.879 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 21.5 m80 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 121.341 0.591 . . . . 25.0 110.602 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.43 164.46 30.52 Favored Glycine 0 C--N 1.321 -0.262 1 N-CA-C 99.904 -5.278 . . . . 25.0 99.904 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -145.6 162.03 38.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.968 2.384 . . . . 25.0 111.625 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.01 121.62 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 107.95 -1.129 . . . . 25.0 107.95 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -76.02 -42.78 46.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.456 -1.247 . . . . 25.0 109.809 -175.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.2 t -152.86 128.83 5.19 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 106.154 -1.795 . . . . 25.0 106.154 177.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.99 131.74 11.89 Favored 'Cis proline' 0 CA--C 1.534 0.483 0 C-N-CA 128.771 0.738 . . . . 25.0 111.193 -0.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.44 112.61 4.15 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 25.0 112.242 -171.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.9 t -71.97 157.82 37.12 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.378 -0.971 . . . . 25.0 108.378 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -56.12 -24.24 39.46 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.478 0.711 . . . . 25.0 111.826 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.7 -53.09 37.33 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.736 0.779 . . . . 25.0 109.337 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -66.86 -36.72 82.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.599 -0.728 . . . . 25.0 110.482 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -63.38 -31.02 72.07 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.985 -0.286 . . . . 25.0 110.755 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -40.63 95.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.192 0.52 . . . . 25.0 110.276 178.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.466 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.4 tmtm? -70.19 -33.55 71.86 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.04 0.448 . . . . 25.0 110.09 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -76.14 2.53 12.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.385 -0.37 . . . . 25.0 111.488 174.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 58.1 22.78 9.37 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.353 1.461 . . . . 25.0 113.093 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.451 ' C ' HD21 ' A' ' 19' ' ' ASN . 94.8 mt -85.83 -21.86 27.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.148 -1.427 . . . . 25.0 107.148 173.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.451 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.89 159.08 30.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.9 p -136.72 175.96 9.14 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.881 -0.414 . . . . 25.0 109.881 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 72.62 5.22 5.19 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.523 1.675 . . . . 25.0 115.523 173.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -67.77 -36.51 80.62 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.671 -0.643 . . . . 25.0 111.282 173.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -63.25 1.67 Allowed Glycine 0 C--O 1.218 -0.858 0 O-C-N 123.552 0.532 . . . . 25.0 112.241 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -88.09 -53.86 4.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.5 1.143 . . . . 25.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -7.15 7.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.401 -171.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.73 3.16 51.82 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.844 -0.535 . . . . 25.0 111.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -119.77 -33.99 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.272 -0.571 . . . . 25.0 110.911 173.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.98 107.46 22.07 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 107.746 -1.205 . . . . 25.0 107.746 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.466 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.7 Cg_endo -73.05 -19.23 23.24 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 116.276 -2.016 . . . . 25.0 114.389 -175.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -85.92 9.37 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.356 0.502 . . . . 25.0 112.356 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -61.4 -18.29 58.15 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.814 0.672 . . . . 25.0 112.814 178.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.4 m -65.29 124.21 19.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 114.721 1.378 . . . . 25.0 114.721 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -152.97 158.8 42.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.303 -1.74 . . . . 25.0 106.303 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.84 -166.57 18.99 Favored Glycine 0 N--CA 1.453 -0.172 0 N-CA-C 107.395 -2.282 . . . . 25.0 107.395 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.79 149.52 43.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 118.487 1.144 . . . . 25.0 112.31 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -67.03 156.93 34.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 107.126 -1.435 . . . . 25.0 107.126 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.18 -5.41 1.9 Allowed Glycine 0 C--N 1.318 -0.457 0 CA-C-N 114.953 -1.022 . . . . 25.0 112.394 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -75.97 145.85 78.15 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.25 -1.018 . . . . 25.0 108.25 -178.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -90.08 -19.99 13.05 Favored 'Cis proline' 0 CA--C 1.542 0.883 0 N-CA-C 115.859 1.446 . . . . 25.0 115.859 -4.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -71.08 -35.61 71.93 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.576 1.324 . . . . 25.0 114.576 -169.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.69 35.98 4.19 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.64 -1.985 . . . . 25.0 105.64 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -85.45 175.69 49.51 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.735 -1.121 . . . . 25.0 110.941 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.39 172.93 3.81 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 123.134 2.556 . . . . 25.0 113.616 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.0 30.99 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.203 -1.777 . . . . 25.0 106.203 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.71 139.56 57.83 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.504 -1.225 . . . . 25.0 107.725 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 -4.98 84.88 Favored Glycine 0 C--O 1.227 -0.316 0 C-N-CA 121.279 -0.486 . . . . 25.0 113.125 -174.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 55.1 m170 -124.82 10.28 8.3 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.349 -0.5 . . . . 25.0 109.816 177.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.1 mt -66.25 -45.27 90.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.31 -0.244 . . . . 25.0 110.903 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.44 -27.61 60.68 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.546 -0.539 . . . . 25.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.3 p -79.93 -7.66 58.89 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.459 0.911 . . . . 25.0 113.459 -176.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 35.53 18.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.582 0.753 . . . . 25.0 110.294 -173.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.8 OUTLIER 62.42 30.34 17.29 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.646 1.35 . . . . 25.0 114.646 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -117.51 137.33 52.62 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.828 -0.545 . . . . 25.0 111.992 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.99 -35.89 81.73 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 115.585 1.698 . . . . 25.0 115.585 -173.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.3 t -71.31 -4.87 28.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.522 0.564 . . . . 25.0 112.522 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -123.39 11.9 9.36 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -73.57 -34.79 65.31 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.152 -0.968 . . . . 25.0 109.813 -176.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -71.61 -14.06 61.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.871 0.843 . . . . 25.0 109.419 175.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.6 mp -90.46 -2.26 57.93 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.43 -32.19 6.0 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.312 0.577 . . . . 25.0 110.969 173.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.8 115.03 24.97 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 121.773 -0.579 . . . . 25.0 110.193 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -127.62 160.92 30.13 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.129 0.49 . . . . 25.0 110.027 176.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.401 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 33.0 p -119.87 162.45 33.03 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 100.384 -3.932 . . . . 25.0 100.384 162.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -70.12 -3.44 12.26 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 116.32 -1.987 . . . . 25.0 115.853 -175.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -122.37 7.74 9.62 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.656 0.741 . . . . 25.0 111.529 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -76.87 -28.54 55.45 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.345 -0.847 . . . . 25.0 113.204 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.481 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.3 m95 -126.92 167.23 16.14 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.741 0.305 . . . . 25.0 111.337 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -67.77 119.92 13.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.944 -1.873 . . . . 25.0 105.944 169.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.7 mmtt -95.43 105.24 17.19 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 100.507 -3.886 . . . . 25.0 100.507 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 135.32 54.6 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.664 -1.153 . . . . 25.0 110.291 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -92.0 101.73 14.28 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.173 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.6 mt -130.23 173.94 10.29 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.207 -1.034 . . . . 25.0 108.207 -175.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.85 157.33 22.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.364 -0.835 . . . . 25.0 111.224 -175.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 68.5 p -77.36 167.82 21.06 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.854 -1.535 . . . . 25.0 106.854 173.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.75 -161.87 23.97 Favored Glycine 0 C--O 1.241 0.543 0 N-CA-C 110.856 -0.897 . . . . 25.0 110.856 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.93 133.57 54.48 Favored 'Trans proline' 0 C--N 1.345 0.346 0 CA-C-N 118.989 1.394 . . . . 25.0 114.289 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -140.46 160.26 40.38 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.168 -1.79 . . . . 25.0 106.168 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 p -104.41 152.36 22.4 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 178.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -138.34 100.99 4.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 105.618 -1.993 . . . . 25.0 105.618 -178.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.86 119.21 38.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.876 0.846 . . . . 25.0 109.006 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.6 m95 -104.63 148.0 27.02 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.031 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -127.75 107.71 10.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.97 125.09 50.87 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 123.958 0.903 . . . . 25.0 112.187 -175.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -80.46 -20.22 44.27 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.297 -1.001 . . . . 25.0 108.297 168.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.85 108.62 16.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.85 -0.614 . . . . 25.0 111.586 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -77.63 0.57 22.72 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.869 1.433 . . . . 25.0 114.869 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.6 154.33 42.15 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.057 0.389 . . . . 25.0 110.21 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.5 t -70.57 155.91 40.11 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -171.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.2 t -97.78 159.37 14.97 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.281 -1.007 . . . . 25.0 108.281 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.5 t -117.77 -16.19 10.02 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 123.145 0.278 . . . . 25.0 111.322 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.5 t -172.13 153.24 3.05 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.991 0.424 . . . . 25.0 112.112 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.88 138.29 53.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 103.837 -2.653 . . . . 25.0 103.837 167.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -142.64 147.24 35.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -135.35 133.47 38.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -147.26 163.22 37.09 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.303 -0.628 . . . . 25.0 109.303 178.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.04 164.93 32.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 114.465 1.283 . . . . 25.0 114.465 -167.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.08 158.28 26.47 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 106.934 -1.506 . . . . 25.0 106.934 168.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -63.14 158.72 53.49 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.241 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.89 -20.55 38.92 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 116.681 -1.746 . . . . 25.0 114.252 -174.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -120.55 32.05 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.552 0.575 . . . . 25.0 112.552 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.524 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -71.89 165.51 24.0 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.932 0.873 . . . . 25.0 111.558 -179.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.04 101.01 10.84 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.725 -1.125 . . . . 25.0 109.706 -179.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.524 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.16 15.21 6.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.636 2.087 . . . . 25.0 116.636 -169.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.4 t -124.17 9.24 8.61 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -113.16 156.63 42.69 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 107.465 -1.309 . . . . 25.0 107.465 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.57 156.31 66.19 Favored 'Trans proline' 0 C--N 1.345 0.343 0 O-C-N 121.918 0.431 . . . . 25.0 112.016 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.52 104.24 3.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.187 0.517 . . . . 25.0 111.395 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.3 p -92.61 159.56 15.42 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -65.69 -25.97 67.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.159 0.504 . . . . 25.0 110.719 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.58 -22.48 60.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.481 -0.782 . . . . 25.0 112.745 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 21.2 m -77.39 -12.11 59.92 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.07 0.396 . . . . 25.0 112.07 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -99.77 158.35 15.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 114.555 1.317 . . . . 25.0 114.555 -175.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -96.02 98.23 10.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 102.38 -3.193 . . . . 25.0 102.38 161.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 74.8 mt -66.86 -7.62 23.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 115.003 1.483 . . . . 25.0 115.003 -169.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -83.8 131.37 52.1 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 108.706 -0.85 . . . . 25.0 108.706 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -72.54 150.44 51.38 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 115.15 -2.767 . . . . 25.0 111.047 177.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -102.25 -11.85 18.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.399 . . . . 25.0 111.603 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 64.0 m -149.84 66.87 0.99 Allowed 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 116.234 -0.439 . . . . 25.0 110.742 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -89.06 133.47 34.34 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.078 -1.049 . . . . 25.0 109.01 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -123.78 99.07 6.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 104.833 -2.284 . . . . 25.0 104.833 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.9 92.11 8.19 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.129 -1.434 . . . . 25.0 107.129 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -105.98 118.2 36.0 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.065 -1.457 . . . . 25.0 107.065 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.99 82.45 0.37 Allowed Glycine 0 CA--C 1.501 -0.826 0 CA-C-N 115.476 -0.784 . . . . 25.0 112.609 -170.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.4 13.99 6.06 Favored Glycine 0 C--N 1.32 -0.332 0 C-N-CA 120.998 -0.62 . . . . 25.0 113.357 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.49 104.0 5.04 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.514 0.673 . . . . 25.0 109.542 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 83.6 mt -73.57 124.5 90.42 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 106.367 -1.716 . . . . 25.0 106.367 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.47 158.74 53.28 Favored 'Trans proline' 0 C--N 1.345 0.384 0 N-CA-C 113.645 0.594 . . . . 25.0 113.645 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.447 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.48 28.66 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.81 -17.92 0.33 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.962 1.705 . . . . 25.0 111.508 -173.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.447 ' H ' ' C ' ' A' ' 128' ' ' ALA . 50.2 mt-30 -127.68 150.8 49.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 104.668 -2.345 . . . . 25.0 104.668 169.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 46.0 t -141.02 95.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 106.764 -1.569 . . . . 25.0 106.764 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.9 t -89.65 126.88 35.8 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 107.509 -1.293 . . . . 25.0 107.509 175.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.11 166.86 20.16 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 105.443 -2.058 . . . . 25.0 105.443 177.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -136.01 152.7 51.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 104.825 -2.287 . . . . 25.0 104.825 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.69 159.35 30.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.525 -0.917 . . . . 25.0 108.525 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -103.8 115.69 30.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.391 -0.368 . . . . 25.0 110.902 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.01 131.57 72.74 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 107.891 -1.151 . . . . 25.0 107.891 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.94 147.11 95.85 Favored 'Trans proline' 0 C--N 1.354 0.861 0 CA-C-O 121.642 0.601 . . . . 25.0 113.504 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.61 -26.77 37.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.132 -0.94 . . . . 25.0 112.745 -168.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -82.67 8.45 11.99 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.565 0.698 . . . . 25.0 110.321 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -114.5 51.87 0.87 Allowed 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.816 0.817 . . . . 25.0 109.144 173.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.7 p -85.98 163.33 18.05 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 93.6 -169.28 29.95 Favored Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 115.243 0.857 . . . . 25.0 115.243 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.05 108.33 18.21 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.358 0.599 . . . . 25.0 110.86 -168.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -157.39 169.44 24.72 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.86 -0.609 . . . . 25.0 112.015 -176.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.3 148.16 10.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 N-CA-C 108.427 -0.953 . . . . 25.0 108.427 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 65.7 mt -131.03 121.21 49.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 104.776 -2.305 . . . . 25.0 104.776 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.14 130.52 53.3 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.32 -0.855 . . . . 25.0 109.963 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.16 123.9 46.65 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.043 -0.725 . . . . 25.0 109.043 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.9 p -114.11 137.78 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.952 0.882 . . . . 25.0 111.653 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -112.09 118.99 36.92 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.933 -1.506 . . . . 25.0 106.933 176.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.71 126.45 45.75 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.745 -0.835 . . . . 25.0 108.745 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.3 mm -80.84 143.05 12.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 109.071 -0.714 . . . . 25.0 109.071 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.98 -45.98 17.47 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.724 0.693 . . . . 25.0 110.212 175.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -68.13 -22.55 64.87 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.45 1.278 . . . . 25.0 114.45 -172.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -137.45 168.52 19.48 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.965 0.888 . . . . 25.0 110.084 -174.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.41 21.4 0.62 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.097 -0.956 . . . . 25.0 112.533 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -93.62 146.34 23.89 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.024 0.75 . . . . 25.0 113.024 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.34 143.62 15.18 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.088 -2.19 . . . . 25.0 105.088 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -148.51 136.05 20.53 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.958 0.725 . . . . 25.0 112.958 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -92.0 113.99 26.42 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.199 0.599 . . . . 25.0 111.598 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.1 108.67 21.45 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.056 -0.72 . . . . 25.0 109.056 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.24 142.19 30.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.596 -0.729 . . . . 25.0 112.198 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.5 136.37 61.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.264 -2.125 . . . . 25.0 105.264 166.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -97.73 130.35 44.7 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 176.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.56 162.8 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 112.74 0.645 . . . . 25.0 112.74 -174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -118.25 95.04 4.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 104.348 -2.464 . . . . 25.0 104.348 167.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -89.99 163.72 14.82 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 112.242 0.46 . . . . 25.0 112.242 -171.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.6 p -143.42 154.96 44.24 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 176.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.418 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.135 -0.936 . . . . 25.0 111.086 -178.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.0 m170 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.891 0.377 . . . . 25.0 110.658 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.55 165.89 20.37 Favored Glycine 0 C--O 1.229 -0.167 1 N-CA-C 102.362 -4.295 . . . . 25.0 102.362 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -148.04 163.55 36.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 120.561 2.181 . . . . 25.0 111.916 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -100.2 123.36 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -77.8 -42.61 33.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.604 -1.18 . . . . 25.0 110.265 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -152.45 129.23 5.5 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.91 131.55 11.4 Favored 'Cis proline' 0 C--N 1.348 0.502 0 CA-C-N 118.83 0.618 . . . . 25.0 111.118 -0.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 109.87 2.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.931 -0.577 . . . . 25.0 112.15 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 t -72.03 157.55 37.59 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -56.09 -24.3 39.41 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.337 0.655 . . . . 25.0 111.985 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.12 -53.69 41.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.803 0.811 . . . . 25.0 109.262 175.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -67.11 -36.42 81.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 25.0 110.463 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -61.92 -32.55 72.96 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 121.106 -0.237 . . . . 25.0 111.028 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -40.84 97.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.306 0.574 . . . . 25.0 110.519 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.441 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.77 -33.04 70.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.066 0.46 . . . . 25.0 110.031 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.1 mt -76.12 5.4 6.83 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.425 -0.352 . . . . 25.0 111.777 175.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 62.9 14.82 7.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.621 1.168 . . . . 25.0 113.352 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.459 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.1 mt -84.06 -22.55 31.18 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.719 -0.845 . . . . 25.0 108.719 176.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.459 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.7 m120 -124.46 158.91 31.7 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 104.792 -2.299 . . . . 25.0 104.792 176.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.9 p -137.65 174.01 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.081 -0.341 . . . . 25.0 110.081 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 70.25 5.02 5.13 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 116.681 2.104 . . . . 25.0 116.681 176.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.7 m -64.57 -32.33 73.94 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 121.916 -0.49 . . . . 25.0 110.388 172.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 -63.08 1.79 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.818 0.699 . . . . 25.0 112.023 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.6 t -88.06 -53.48 4.7 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.611 1.196 . . . . 25.0 111.587 -178.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -68.1 -12.72 16.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.376 -1.284 . . . . 25.0 112.931 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -84.69 -0.82 54.89 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 121.852 -0.53 . . . . 25.0 111.865 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -117.56 -34.16 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.047 -0.661 . . . . 25.0 110.376 172.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.04 104.67 22.63 Favored Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 109.531 -0.544 . . . . 25.0 109.531 171.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.441 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.6 Cg_endo -74.89 -19.78 17.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 116.758 -1.695 . . . . 25.0 113.963 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -86.37 12.85 9.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.934 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -66.48 -14.0 61.62 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.754 0.312 . . . . 25.0 111.613 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 19.4 m -64.02 129.23 27.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 113.839 1.051 . . . . 25.0 113.839 -177.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -152.93 152.4 31.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.383 -1.34 . . . . 25.0 107.383 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.86 -172.96 27.74 Favored Glycine 0 N--CA 1.455 -0.094 0 N-CA-C 108.843 -1.703 . . . . 25.0 108.843 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.0 148.27 47.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 118.426 1.113 . . . . 25.0 111.827 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.14 156.92 32.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.12 -1.437 . . . . 25.0 107.12 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.42 2.13 2.99 Favored Glycine 0 C--N 1.318 -0.45 0 CA-C-N 114.929 -1.032 . . . . 25.0 112.919 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -75.91 141.39 71.52 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -93.0 -13.46 20.96 Favored 'Cis proline' 0 CA--C 1.543 0.948 0 C-N-CA 130.474 1.447 . . . . 25.0 115.469 -6.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.88 -37.07 75.93 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.483 1.29 . . . . 25.0 114.483 -169.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.01 30.91 6.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.251 -2.129 . . . . 25.0 105.251 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.98 179.05 43.92 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.899 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -62.6 173.0 3.91 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.743 2.295 . . . . 25.0 113.628 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.01 30.99 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -60.54 140.02 57.52 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 107.001 -1.481 . . . . 25.0 107.001 174.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.03 -5.01 78.42 Favored Glycine 0 N--CA 1.459 0.176 0 CA-C-O 121.817 0.676 . . . . 25.0 112.583 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -126.03 8.4 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.998 -0.741 . . . . 25.0 108.998 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.94 -52.76 49.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 122.308 -0.245 . . . . 25.0 111.637 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.57 -21.11 59.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.372 -0.603 . . . . 25.0 109.372 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.0 p -81.86 -7.62 59.62 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.597 0.592 . . . . 25.0 112.597 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.29 31.19 11.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.512 0.725 . . . . 25.0 110.33 -173.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.57 36.58 25.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.715 1.376 . . . . 25.0 114.715 -176.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -120.73 136.29 54.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.992 0.517 . . . . 25.0 110.585 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.08 -33.89 75.27 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 115.234 1.568 . . . . 25.0 115.234 -174.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.12 -7.15 44.62 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.622 0.601 . . . . 25.0 112.622 -178.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 m-85 -120.84 13.09 11.43 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -71.37 -37.23 71.64 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.243 -0.91 . . . . 25.0 111.338 -176.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -69.82 -17.98 63.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.294 1.045 . . . . 25.0 108.757 177.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.4 ' CD1' ' HA ' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -85.51 -8.19 58.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.081 -0.963 . . . . 25.0 109.174 -177.384 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -113.12 -36.13 5.16 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.671 1.36 . . . . 25.0 114.671 176.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -104.92 125.94 51.46 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.102 -0.999 . . . . 25.0 110.821 -176.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.5 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.4 pm0 -127.73 161.05 29.84 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.286 -1.325 . . . . 25.0 110.029 -176.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -112.6 162.66 20.54 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 100.663 -3.829 . . . . 25.0 100.663 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -70.45 -0.14 7.04 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 N-CA-C 116.129 1.55 . . . . 25.0 116.129 -174.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -127.92 13.64 6.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.587 0.708 . . . . 25.0 110.251 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -30.48 45.19 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.825 1.046 . . . . 25.0 113.825 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.5 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 15.8 m95 -126.77 167.89 15.16 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.599 -0.519 . . . . 25.0 109.599 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -66.46 126.89 30.27 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.246 -1.761 . . . . 25.0 106.246 171.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -98.97 106.19 18.42 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 100.543 -3.873 . . . . 25.0 100.543 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.63 134.66 52.77 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.06 -0.973 . . . . 25.0 110.259 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -91.69 100.66 13.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.691 -1.14 . . . . 25.0 108.021 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.5 mt -131.89 173.96 10.65 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.135 -1.061 . . . . 25.0 108.135 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.78 156.38 23.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.944 -176.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 53.3 p -77.13 167.9 20.99 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.163 -1.421 . . . . 25.0 107.163 172.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.26 -160.78 23.04 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 110.518 -1.033 . . . . 25.0 110.518 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.87 132.98 50.81 Favored 'Trans proline' 0 C--N 1.345 0.387 0 CA-C-N 119.202 1.501 . . . . 25.0 114.079 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.31 161.98 36.39 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.7 p -101.52 150.86 22.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.829 -1.175 . . . . 25.0 107.829 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -137.66 100.96 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.98 121.46 45.41 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 123.923 0.889 . . . . 25.0 109.52 -177.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -107.36 152.18 24.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.035 -0.984 . . . . 25.0 110.161 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -129.35 114.54 16.33 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 104.789 -2.3 . . . . 25.0 104.789 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.8 mp -115.05 117.87 31.8 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.193 -173.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -81.91 6.58 15.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.302 0.572 . . . . 25.0 111.272 173.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -122.62 132.32 54.23 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.979 -0.451 . . . . 25.0 110.345 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -80.63 -9.63 59.78 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.874 0.694 . . . . 25.0 112.874 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.15 155.58 31.16 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.19 0.441 . . . . 25.0 112.19 -176.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 t -76.99 155.89 32.3 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.819 0.818 . . . . 25.0 112.859 -175.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.461 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 6.6 t -97.92 158.24 15.64 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.502 -1.296 . . . . 25.0 107.502 173.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -117.92 -15.6 9.98 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.102 0.251 . . . . 25.0 111.195 172.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -171.99 150.25 2.52 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.312 0.486 . . . . 25.0 112.312 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -123.94 138.54 54.45 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.457 -2.423 . . . . 25.0 104.457 167.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.6 mtt-85 -137.27 144.76 42.87 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -137.94 127.52 25.05 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.686 -1.598 . . . . 25.0 106.686 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -147.74 168.76 21.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.675 -0.861 . . . . 25.0 108.675 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.51 167.38 26.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 113.394 0.887 . . . . 25.0 113.394 -168.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.3 p -79.06 160.53 27.07 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.735 . . . . 25.0 106.317 167.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -62.13 159.0 41.66 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.708 -0.678 . . . . 25.0 109.553 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.26 -24.53 37.6 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 116.923 -1.584 . . . . 25.0 113.056 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -115.02 32.06 6.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.092 0.557 . . . . 25.0 110.762 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.532 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -72.68 165.42 24.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.135 0.969 . . . . 25.0 113.577 -174.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -83.17 101.04 10.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.377 -1.283 . . . . 25.0 110.293 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.532 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.93 7.99 28.34 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 117.715 2.487 . . . . 25.0 117.715 -168.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.0 t -123.44 8.32 9.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.778 0.799 . . . . 25.0 109.231 176.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -107.25 160.52 26.18 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 114.541 -1.209 . . . . 25.0 108.916 -172.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -64.53 152.51 81.42 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 118.051 -0.833 . . . . 25.0 111.412 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -71.59 100.14 2.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.498 0.666 . . . . 25.0 110.868 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -88.96 153.97 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.503 -1.295 . . . . 25.0 107.503 176.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.21 -25.93 68.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.257 0.551 . . . . 25.0 111.167 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.47 61.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.333 -0.849 . . . . 25.0 112.801 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.4 t -79.29 -3.93 48.36 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.196 0.443 . . . . 25.0 112.196 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -106.01 155.58 19.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -96.47 91.24 5.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 101.952 -3.351 . . . . 25.0 101.952 161.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.82 -7.11 37.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -171.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.39 119.6 77.79 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.862 -1.162 . . . . 25.0 107.862 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -72.09 143.27 39.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 114.998 -2.868 . . . . 25.0 112.416 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -95.0 -14.59 24.22 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.064 0.394 . . . . 25.0 112.064 -176.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 75.1 m -147.94 62.77 1.12 Allowed 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.827 0.306 . . . . 25.0 111.827 178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -88.96 139.46 30.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 118.24 -1.384 . . . . 25.0 108.705 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -124.92 99.12 5.99 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -92.47 92.12 7.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.016 -1.476 . . . . 25.0 107.016 -176.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -106.15 117.9 35.24 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.438 -0.949 . . . . 25.0 108.438 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -96.92 77.88 0.69 Allowed Glycine 0 CA--C 1.504 -0.628 0 CA-C-N 115.45 -0.795 . . . . 25.0 114.023 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.93 20.39 5.3 Favored Glycine 0 C--N 1.321 -0.275 0 C-N-CA 120.882 -0.675 . . . . 25.0 113.862 178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.38 105.13 5.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.497 0.665 . . . . 25.0 109.828 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.24 125.99 91.24 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 105.563 -2.014 . . . . 25.0 105.563 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.5 169.14 23.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 118.369 -0.621 . . . . 25.0 113.598 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.457 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.22 31.49 4.26 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.372 -1.344 . . . . 25.0 107.372 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.66 -17.94 0.27 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.94 1.696 . . . . 25.0 112.132 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.457 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.9 mt-30 -129.25 155.47 45.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 104.703 -2.332 . . . . 25.0 104.703 171.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.1 t -140.72 95.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.417 -2.068 . . . . 25.0 105.417 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.9 t -95.52 142.58 27.7 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -156.95 167.03 31.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 113.709 -1.587 . . . . 25.0 108.628 -175.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -129.77 156.89 43.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.88 -1.526 . . . . 25.0 106.88 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.12 161.35 31.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.483 -1.302 . . . . 25.0 107.483 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -105.09 117.16 33.3 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.085 0.241 . . . . 25.0 111.101 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.54 132.25 69.48 Favored Pre-proline 0 CA--C 1.541 0.628 0 N-CA-C 107.888 -1.152 . . . . 25.0 107.888 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -61.26 145.75 98.14 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-O 121.705 0.627 . . . . 25.0 113.472 -179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.62 -25.64 35.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.178 -0.919 . . . . 25.0 112.665 -168.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -84.24 9.77 12.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.611 0.719 . . . . 25.0 110.212 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -115.18 53.55 0.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.345 -0.983 . . . . 25.0 108.345 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.9 p -86.12 165.45 16.59 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 106.748 -1.575 . . . . 25.0 106.748 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.14 -167.08 32.68 Favored Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 115.368 0.907 . . . . 25.0 115.368 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.7 t -86.0 108.13 18.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.959 0.409 . . . . 25.0 110.799 -168.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 38.5 p-80 -158.53 168.39 27.04 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 113.816 1.043 . . . . 25.0 113.816 -174.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 16.1 t -100.91 146.24 9.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.376 -0.972 . . . . 25.0 108.376 -179.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.81 129.65 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 102.114 -3.291 . . . . 25.0 102.114 179.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.44 132.57 54.98 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.522 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -113.09 111.88 22.88 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -106.31 142.19 19.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.356 0.598 . . . . 25.0 110.087 -176.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.461 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 18.2 t90 -123.63 124.31 42.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.0 -1.0 . . . . 25.0 108.608 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -105.21 129.46 53.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.998 -0.742 . . . . 25.0 108.998 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.2 mm -85.97 141.11 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.313 -0.625 . . . . 25.0 109.313 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.78 20.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.714 0.688 . . . . 25.0 110.528 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -23.33 64.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.077 1.14 . . . . 25.0 114.077 -171.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.5 p -138.39 169.9 16.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 122.046 0.926 . . . . 25.0 110.32 -174.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.97 19.05 0.73 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.999 -1.0 . . . . 25.0 112.325 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -90.3 147.62 23.38 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.66 -0.65 . . . . 25.0 112.528 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.05 144.67 19.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 104.414 -2.439 . . . . 25.0 104.414 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -143.43 147.94 35.37 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.721 0.237 . . . . 25.0 110.51 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -109.4 107.76 18.04 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.856 0.863 . . . . 25.0 109.666 -174.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.13 20.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.189 0.519 . . . . 25.0 110.142 -177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.56 145.93 26.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.953 -0.567 . . . . 25.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.87 147.09 32.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 103.782 -2.673 . . . . 25.0 103.782 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -110.75 130.64 55.52 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.241 -1.762 . . . . 25.0 106.241 176.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.0 m -132.76 162.45 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.738 0.644 . . . . 25.0 112.738 -173.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -117.98 95.12 4.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 104.336 -2.468 . . . . 25.0 104.336 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.89 163.99 13.83 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 112.919 0.711 . . . . 25.0 112.919 -171.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.4 p -144.74 164.43 31.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.977 -1.12 . . . . 25.0 107.977 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.839 0 CA-C-O 117.592 -1.194 . . . . 25.0 111.959 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.1 m170 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.332 -0.248 . . . . 25.0 110.332 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.33 165.14 33.04 Favored Glycine 0 CA--C 1.509 -0.284 1 N-CA-C 102.887 -4.085 . . . . 25.0 102.887 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -145.78 158.4 43.86 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 119.668 1.734 . . . . 25.0 110.984 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.15 119.56 34.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.72 -43.15 48.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.279 -1.328 . . . . 25.0 109.319 -174.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.8 t -155.37 128.38 4.26 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -63.9 128.52 7.13 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 C-N-CA 129.706 1.128 . . . . 25.0 112.346 0.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.75 116.83 8.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.777 0.658 . . . . 25.0 112.777 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.4 t -72.11 157.84 37.02 Favored 'General case' 0 C--O 1.216 -0.665 0 N-CA-C 109.011 -0.737 . . . . 25.0 109.011 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.93 -25.12 41.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.602 0.761 . . . . 25.0 111.656 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -52.76 44.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.755 0.788 . . . . 25.0 109.155 175.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.94 -36.72 84.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 25.0 110.308 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -63.65 -33.74 76.29 Favored 'General case' 0 C--O 1.219 -0.531 0 O-C-N 122.223 -0.298 . . . . 25.0 110.899 178.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -40.26 96.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.342 0.591 . . . . 25.0 109.915 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.412 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 6.3 tmtm? -68.45 -33.85 74.92 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.212 0.529 . . . . 25.0 110.311 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.5 mt -79.08 5.14 12.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 25.0 111.276 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 58.7 24.77 12.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.177 1.391 . . . . 25.0 112.909 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.442 ' C ' HD21 ' A' ' 19' ' ' ASN . 89.3 mt -89.7 -21.44 22.72 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.914 -1.143 . . . . 25.0 107.914 174.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.442 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.51 160.28 27.3 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 105.669 -1.974 . . . . 25.0 105.669 177.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 42.6 p -134.31 175.13 9.78 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 122.449 0.3 . . . . 25.0 110.456 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 69.39 5.23 5.03 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.877 1.806 . . . . 25.0 115.877 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -66.67 -38.52 86.99 Favored 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 121.344 -0.848 . . . . 25.0 111.145 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -63.33 1.54 Allowed Glycine 0 C--O 1.218 -0.9 0 O-C-N 123.55 0.531 . . . . 25.0 112.449 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -53.73 4.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.549 1.166 . . . . 25.0 111.806 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -7.03 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.603 -1.18 . . . . 25.0 113.63 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -88.27 2.0 53.32 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.8 -0.563 . . . . 25.0 111.102 178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -117.65 -34.05 4.36 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.742 -0.383 . . . . 25.0 110.791 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -126.93 107.62 22.2 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 172.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.412 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 84.1 Cg_endo -76.9 -18.55 14.71 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 116.867 -1.622 . . . . 25.0 113.797 -171.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -90.66 12.01 20.34 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.64 0.607 . . . . 25.0 112.64 -177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.0 m -62.18 -17.93 59.5 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.092 0.472 . . . . 25.0 112.121 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.1 120.65 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.81 0.814 . . . . 25.0 112.695 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -152.99 156.5 38.96 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.56 -169.05 24.34 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -176.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.7 tp -118.18 147.77 43.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.216 1.008 . . . . 25.0 111.917 -176.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.46 156.88 31.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 172.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 139.95 1.69 1.76 Allowed Glycine 0 C--O 1.223 -0.536 0 CA-C-N 114.768 -1.105 . . . . 25.0 113.195 179.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -75.99 139.07 69.07 Favored Pre-proline 0 C--N 1.321 -0.655 0 O-C-N 121.569 -0.959 . . . . 25.0 109.631 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.2 -13.13 21.23 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 C-N-CA 130.438 1.433 . . . . 25.0 115.509 -6.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -71.63 -36.76 70.86 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -168.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.69 31.95 5.74 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.26 -174.42 42.05 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.336 -1.302 . . . . 25.0 110.859 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -61.96 170.26 6.33 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.446 2.097 . . . . 25.0 113.097 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 159.97 31.12 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 106.592 -1.633 . . . . 25.0 106.592 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.62 138.84 58.01 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.563 -1.199 . . . . 25.0 108.34 177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.36 -4.12 82.46 Favored Glycine 0 C--O 1.227 -0.296 0 C-N-CA 121.216 -0.516 . . . . 25.0 112.844 -174.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -124.45 9.08 8.42 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.656 -0.868 . . . . 25.0 108.656 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.79 -47.27 86.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 O-C-N 122.405 -0.185 . . . . 25.0 110.906 -172.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.02 -18.46 58.13 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.024 -0.423 . . . . 25.0 110.182 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 p -87.97 -7.17 57.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.41 32.81 11.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.659 0.784 . . . . 25.0 110.412 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.96 37.08 24.69 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -177.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -120.7 137.28 54.55 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.124 0.569 . . . . 25.0 111.11 175.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.7 p -62.62 -35.43 79.54 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.378 1.621 . . . . 25.0 115.378 -174.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -71.56 -6.97 44.68 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.615 0.598 . . . . 25.0 112.615 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.41 ' HA ' HD11 ' A' ' 59' ' ' LEU . 14.6 m-85 -120.44 11.91 11.51 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 107.32 -1.363 . . . . 25.0 107.32 -179.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.62 -34.47 67.35 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.051 -1.031 . . . . 25.0 110.084 -175.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -71.27 -15.56 62.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.947 0.879 . . . . 25.0 109.945 174.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.91 -6.48 58.04 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 -177.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.55 -32.36 6.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.097 0.475 . . . . 25.0 111.81 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -98.15 121.91 40.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 121.743 -0.598 . . . . 25.0 110.052 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.453 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -129.68 160.97 31.69 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.022 -0.733 . . . . 25.0 109.022 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.7 p -115.79 162.39 25.64 Favored Pre-proline 0 C--N 1.321 -0.666 1 N-CA-C 100.108 -4.034 . . . . 25.0 100.108 162.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.9 -4.9 14.34 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 116.744 -1.704 . . . . 25.0 115.586 -175.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -125.15 10.7 8.13 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.079 0.466 . . . . 25.0 111.783 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -77.72 -30.14 51.59 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.657 -0.652 . . . . 25.0 112.593 -176.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 10.4 m95 -125.07 164.7 19.63 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.85 -0.426 . . . . 25.0 109.85 -178.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -66.83 129.15 38.95 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 171.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -100.9 105.54 16.81 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 100.694 -3.817 . . . . 25.0 100.694 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.9 mp -68.54 136.31 52.92 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.12 -0.946 . . . . 25.0 110.784 -176.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -88.26 111.92 22.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.915 -1.039 . . . . 25.0 108.856 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.1 mt -137.09 173.19 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.143 -1.058 . . . . 25.0 108.143 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.22 156.3 25.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.704 -0.68 . . . . 25.0 110.467 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -76.95 170.47 16.45 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 92.44 -161.87 26.54 Favored Glycine 0 C--O 1.239 0.456 0 CA-C-O 118.95 -0.917 . . . . 25.0 110.95 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -58.94 131.2 40.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 CA-C-N 119.149 1.475 . . . . 25.0 113.517 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -139.26 163.11 33.33 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.093 -1.447 . . . . 25.0 107.093 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.8 p -104.17 152.45 22.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.03 -1.1 . . . . 25.0 108.03 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -140.62 101.09 4.01 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 104.917 -2.253 . . . . 25.0 104.917 -177.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.98 134.98 49.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -120.35 153.21 36.79 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.962 -1.472 . . . . 25.0 109.542 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -130.44 117.25 19.39 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 104.21 -2.515 . . . . 25.0 104.21 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.9 137.64 52.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.139 -0.937 . . . . 25.0 111.22 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.8 t -92.75 2.36 56.78 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.984 0.421 . . . . 25.0 111.219 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -128.57 139.46 52.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.932 0.396 . . . . 25.0 111.142 -177.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.3 mmm-85 -92.06 1.77 56.99 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.895 -0.593 . . . . 25.0 112.49 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.25 148.81 49.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.591 -0.444 . . . . 25.0 110.083 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.4 t -71.8 155.93 39.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.078 1.14 . . . . 25.0 114.078 -170.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.8 t -99.03 159.45 14.95 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.179 -1.045 . . . . 25.0 108.179 173.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -117.96 -13.75 10.03 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.125 0.266 . . . . 25.0 110.589 170.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.62 151.87 2.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.803 0.335 . . . . 25.0 111.325 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 63.1 m95 -122.72 141.51 51.71 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.274 -2.491 . . . . 25.0 104.274 165.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -145.34 152.98 40.74 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.727 -1.212 . . . . 25.0 107.727 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -136.71 134.81 37.58 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.786 -1.931 . . . . 25.0 105.786 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.59 165.23 31.0 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.196 0.453 . . . . 25.0 109.822 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.01 167.83 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 113.713 1.005 . . . . 25.0 113.713 -166.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.9 p -82.25 163.78 21.62 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.235 -1.024 . . . . 25.0 108.235 168.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.39 159.38 41.26 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.349 -0.842 . . . . 25.0 109.355 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.87 -24.23 34.2 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 116.063 -2.158 . . . . 25.0 113.581 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -115.58 31.87 6.43 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 122.915 0.486 . . . . 25.0 111.069 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' TRP . . . . . 0.512 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 7.0 p-90 -71.98 166.57 21.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.13 0.967 . . . . 25.0 112.524 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.06 101.04 10.87 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.51 -1.223 . . . . 25.0 109.212 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.11 15.13 10.76 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 116.041 1.867 . . . . 25.0 116.041 -169.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -128.1 13.2 6.71 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.701 -0.852 . . . . 25.0 108.701 176.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -117.54 157.24 48.11 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.521 -1.218 . . . . 25.0 107.976 -174.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -64.93 153.2 79.33 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 O-C-N 121.961 0.453 . . . . 25.0 111.798 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.63 103.77 4.34 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.58 0.705 . . . . 25.0 112.308 -175.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 19.9 p -98.02 161.41 13.74 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.157 -0.683 . . . . 25.0 109.157 177.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -68.03 -23.39 64.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.234 0.54 . . . . 25.0 111.029 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.69 63.4 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.212 -0.904 . . . . 25.0 112.034 176.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.3 m -85.65 -9.73 56.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.115 0.483 . . . . 25.0 111.415 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -95.54 154.58 17.13 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 114.363 1.245 . . . . 25.0 114.363 -177.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -97.74 94.27 6.85 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 102.512 -3.144 . . . . 25.0 102.512 161.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.47 -7.51 20.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.569 1.322 . . . . 25.0 114.569 -170.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -81.79 132.47 54.43 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.061 -0.718 . . . . 25.0 109.061 177.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -72.66 150.92 51.54 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 115.01 -2.86 . . . . 25.0 110.615 176.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -102.32 -9.84 20.01 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.961 0.41 . . . . 25.0 111.17 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 47.7 m -151.86 70.82 0.95 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 25.0 109.793 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.08 135.14 33.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.06 -1.056 . . . . 25.0 108.964 176.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -121.22 99.1 6.3 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.168 -2.901 . . . . 25.0 103.168 177.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -90.32 91.93 8.7 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -113.68 118.44 34.36 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 107.763 -1.199 . . . . 25.0 107.763 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.32 83.71 0.38 Allowed Glycine 0 CA--C 1.5 -0.874 0 CA-C-N 115.311 -0.859 . . . . 25.0 112.564 -170.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.33 14.04 6.64 Favored Glycine 0 C--N 1.32 -0.313 0 C-N-CA 121.054 -0.593 . . . . 25.0 113.253 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.31 105.56 5.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.58 0.705 . . . . 25.0 109.334 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -74.39 121.62 85.64 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 107.039 -1.467 . . . . 25.0 107.039 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -72.32 162.89 40.28 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 118.267 -0.689 . . . . 25.0 112.933 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.14 27.58 5.51 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.665 -0.865 . . . . 25.0 108.665 179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.03 -9.79 0.82 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.604 1.561 . . . . 25.0 111.676 -174.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 128' ' ' ALA . 51.5 mt-30 -132.26 151.81 51.65 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 103.49 -2.782 . . . . 25.0 103.49 170.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 49.4 t -142.03 95.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.638 . . . . 25.0 106.576 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -90.99 138.36 31.67 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.49 164.93 30.97 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 106.287 -1.746 . . . . 25.0 106.287 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -136.46 149.01 48.01 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.962 -2.236 . . . . 25.0 104.962 174.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 160.94 31.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.328 -1.36 . . . . 25.0 107.328 -176.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -101.16 118.44 36.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.528 0.204 . . . . 25.0 111.368 -177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.3 mt -78.94 132.64 63.35 Favored Pre-proline 0 CA--C 1.541 0.625 0 N-CA-C 107.831 -1.174 . . . . 25.0 107.831 176.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -61.52 146.84 96.64 Favored 'Trans proline' 0 C--N 1.355 0.872 0 CA-C-O 121.611 0.588 . . . . 25.0 113.492 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.84 -26.83 33.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.162 -0.927 . . . . 25.0 112.56 -169.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -84.35 9.48 13.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.582 -0.736 . . . . 25.0 110.376 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -113.32 52.98 0.78 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.677 -0.86 . . . . 25.0 108.677 171.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.1 p -85.99 161.72 18.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.48 -165.41 31.14 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 115.562 0.985 . . . . 25.0 115.562 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.1 t -85.82 109.05 18.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.443 0.64 . . . . 25.0 111.267 -168.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.5 p-80 -158.31 171.51 20.04 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.777 -0.647 . . . . 25.0 110.379 -176.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.37 150.64 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.5 mt -132.99 129.29 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 N-CA-C 101.478 -3.527 . . . . 25.0 101.478 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 137.53 53.58 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.102 -0.499 . . . . 25.0 109.78 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -119.02 134.68 55.04 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 109.561 -0.533 . . . . 25.0 109.561 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -124.52 140.09 48.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.126 0.965 . . . . 25.0 111.762 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -111.44 109.7 19.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 113.495 -1.684 . . . . 25.0 106.675 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -91.08 121.5 32.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.431 -1.322 . . . . 25.0 107.431 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.2 mm -79.65 141.75 14.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.528 -0.545 . . . . 25.0 109.528 -178.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.33 -42.14 23.51 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.699 0.681 . . . . 25.0 110.163 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.0 -24.72 65.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.592 0.96 . . . . 25.0 113.592 -172.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 63.5 p -139.53 169.52 17.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.938 0.875 . . . . 25.0 110.084 -174.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.04 23.67 0.55 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.193 -0.912 . . . . 25.0 112.295 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -92.77 146.28 23.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.991 0.738 . . . . 25.0 112.991 -176.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.25 143.12 10.35 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.785 -1.932 . . . . 25.0 105.785 172.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -148.77 132.87 17.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 111.676 0.25 . . . . 25.0 111.676 178.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.12 114.9 26.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.414 0.446 . . . . 25.0 110.821 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -97.11 108.14 20.81 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.65 -0.87 . . . . 25.0 108.65 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.26 139.9 35.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.236 -0.893 . . . . 25.0 113.201 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -125.98 132.69 70.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.998 -1.853 . . . . 25.0 105.998 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -91.39 130.28 37.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.377 -1.342 . . . . 25.0 107.377 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.83 162.19 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.941 0.719 . . . . 25.0 112.941 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -119.95 95.64 4.85 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 104.47 -2.418 . . . . 25.0 104.47 168.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.03 163.23 14.99 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.483 0.549 . . . . 25.0 112.483 -172.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.2 p -143.36 156.31 44.65 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.944 -1.132 . . . . 25.0 107.944 176.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.453 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.013 -0.994 . . . . 25.0 111.466 -177.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.8 m80 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.951 0.405 . . . . 25.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.89 177.27 33.86 Favored Glycine 0 CA--C 1.508 -0.352 1 N-CA-C 101.928 -4.469 . . . . 25.0 101.928 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -145.84 163.95 33.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 119.973 1.886 . . . . 25.0 109.689 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -100.74 122.01 52.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 106.497 -1.668 . . . . 25.0 106.497 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.23 -42.37 59.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.634 -1.166 . . . . 25.0 109.684 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.7 t -153.53 130.18 5.63 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 105.653 -1.98 . . . . 25.0 105.653 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -65.2 132.13 14.46 Favored 'Cis proline' 0 C--N 1.346 0.433 0 CA-C-N 118.783 0.601 . . . . 25.0 111.09 -0.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.37 111.14 3.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.074 -0.512 . . . . 25.0 111.887 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 t -72.21 157.52 37.58 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 109.06 -0.718 . . . . 25.0 109.06 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.44 -24.66 31.82 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.625 0.77 . . . . 25.0 111.757 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.07 -54.61 23.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.933 0.873 . . . . 25.0 109.52 176.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.23 -37.18 84.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.175 -0.921 . . . . 25.0 110.204 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -62.52 -33.29 74.59 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 122.313 -0.242 . . . . 25.0 110.963 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -39.39 93.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.011 0.434 . . . . 25.0 110.725 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -70.04 -35.49 74.33 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.183 0.516 . . . . 25.0 109.669 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.1 mt -74.58 2.61 9.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.162 -0.472 . . . . 25.0 111.561 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 58.19 23.39 10.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.413 1.485 . . . . 25.0 112.926 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.433 ' C ' HD21 ' A' ' 19' ' ' ASN . 90.0 mt -84.96 -21.82 29.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 173.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.433 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -124.02 158.75 31.4 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.243 -2.132 . . . . 25.0 105.243 176.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 p -136.94 176.59 8.57 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.431 -0.581 . . . . 25.0 109.431 -177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 70.51 4.93 5.16 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.579 1.696 . . . . 25.0 115.579 174.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -67.83 -32.54 73.15 Favored 'General case' 0 CA--C 1.496 -1.113 0 O-C-N 121.354 -0.841 . . . . 25.0 110.563 172.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.19 -63.58 1.34 Allowed Glycine 0 C--O 1.215 -1.063 0 O-C-N 123.923 0.765 . . . . 25.0 112.151 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.6 t -88.08 -52.59 5.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.366 1.079 . . . . 25.0 112.343 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -65.97 -15.29 18.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.57 -1.196 . . . . 25.0 112.849 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.401 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 14.6 pt20 -84.33 -3.03 58.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.916 -0.49 . . . . 25.0 111.464 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -117.21 -35.65 3.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.182 -0.607 . . . . 25.0 110.264 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -127.0 94.06 40.33 Favored Pre-proline 0 C--O 1.243 0.76 0 N-CA-C 111.83 0.308 . . . . 25.0 111.83 171.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -74.02 -20.64 19.13 Favored 'Trans proline' 0 C--N 1.346 0.396 0 N-CA-C 115.121 1.162 . . . . 25.0 115.121 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -83.74 9.34 12.04 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.851 -0.531 . . . . 25.0 112.123 -177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.8 m -66.65 -16.05 63.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.789 0.663 . . . . 25.0 112.789 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.6 m -63.97 125.35 20.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.759 1.022 . . . . 25.0 113.759 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -152.95 153.64 33.39 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 105.891 -1.892 . . . . 25.0 105.891 178.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.4 -167.66 16.69 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 108.891 -1.684 . . . . 25.0 108.891 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.0 tp -123.92 142.04 51.5 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.261 1.03 . . . . 25.0 111.506 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.07 157.0 29.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.822 -1.177 . . . . 25.0 107.822 172.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 132.19 6.98 2.97 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 114.804 -1.089 . . . . 25.0 113.507 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -75.77 139.65 70.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 O-C-N 121.564 -0.963 . . . . 25.0 108.889 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -91.87 -15.56 18.95 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 N-CA-C 115.826 1.433 . . . . 25.0 115.826 -5.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -69.18 -36.71 77.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.15 1.537 . . . . 25.0 115.15 -169.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.14 30.28 7.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.641 -1.985 . . . . 25.0 105.641 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.36 -178.0 42.95 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.397 -1.274 . . . . 25.0 110.824 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -62.1 171.75 4.76 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 122.957 2.438 . . . . 25.0 113.391 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.92 160.02 31.12 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.8 -1.556 . . . . 25.0 106.8 173.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.73 138.7 58.07 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 107.694 -1.224 . . . . 25.0 107.694 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.68 -4.71 81.36 Favored Glycine 0 CA--C 1.51 -0.258 0 C-N-CA 121.267 -0.492 . . . . 25.0 113.045 -174.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -124.01 10.02 8.78 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.74 -0.837 . . . . 25.0 108.74 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.68 -49.77 75.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.716 -0.22 . . . . 25.0 111.516 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.07 -21.47 56.71 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.813 -0.554 . . . . 25.0 109.732 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.6 p -82.75 -8.01 59.62 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.565 0.58 . . . . 25.0 112.565 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.19 33.49 12.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.594 0.757 . . . . 25.0 110.547 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.16 39.12 26.3 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.838 1.422 . . . . 25.0 114.838 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -121.38 135.46 55.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.025 -0.534 . . . . 25.0 110.654 175.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -62.24 -34.4 76.45 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 115.05 1.5 . . . . 25.0 115.05 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.66 -11.48 60.97 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.341 0.591 . . . . 25.0 112.275 -178.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.403 ' HA ' HD12 ' A' ' 59' ' ' LEU . 14.2 m-85 -115.42 13.12 16.45 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 107.474 -1.306 . . . . 25.0 107.474 -178.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -70.74 -37.11 73.43 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.015 -1.053 . . . . 25.0 110.7 -175.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.9 mp0 -69.42 -15.3 63.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.746 0.784 . . . . 25.0 110.421 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.94 -7.67 57.96 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -113.2 -33.54 5.95 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.423 0.527 . . . . 25.0 112.423 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -94.31 121.68 36.08 Favored 'General case' 0 CA--C 1.505 -0.774 0 O-C-N 121.602 -0.686 . . . . 25.0 109.697 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.427 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -129.41 161.0 31.37 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.57 -0.741 . . . . 25.0 109.024 177.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.6 p -118.42 161.46 35.23 Favored Pre-proline 0 C--N 1.319 -0.748 1 N-CA-C 99.978 -4.082 . . . . 25.0 99.978 162.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -69.95 0.04 6.36 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 116.993 -1.538 . . . . 25.0 115.923 -174.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.2 t -127.29 9.25 6.66 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.336 0.495 . . . . 25.0 112.336 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -82.26 -31.15 30.29 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.094 1.146 . . . . 25.0 114.094 -175.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.427 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 15.0 m95 -119.61 164.95 15.09 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 110.41 -0.218 . . . . 25.0 110.41 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -67.54 120.09 13.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.908 -1.886 . . . . 25.0 105.908 171.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -94.7 103.09 15.0 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 100.849 -3.76 . . . . 25.0 100.849 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.18 135.09 55.04 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.935 -1.03 . . . . 25.0 110.397 -177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -89.59 100.88 13.59 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.515 -1.22 . . . . 25.0 107.921 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.4 mt -130.26 173.85 10.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 -176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.64 157.08 23.58 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.584 -0.734 . . . . 25.0 111.008 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 58.6 p -77.12 167.12 22.31 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 106.703 -1.591 . . . . 25.0 106.703 172.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.14 -160.62 24.03 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 110.487 -1.045 . . . . 25.0 110.487 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.06 132.57 48.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 119.122 1.461 . . . . 25.0 114.43 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -138.58 161.68 36.47 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.13 -1.804 . . . . 25.0 106.13 177.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.8 p -103.38 149.85 24.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -137.14 100.97 4.41 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 105.521 -2.029 . . . . 25.0 105.521 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.31 114.72 28.8 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.105 0.955 . . . . 25.0 110.065 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -98.88 146.68 25.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.148 -0.933 . . . . 25.0 109.593 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -125.29 110.43 14.0 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 104.605 -2.368 . . . . 25.0 104.605 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -107.36 135.73 48.36 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.74 -0.664 . . . . 25.0 111.007 -172.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.6 t -98.93 16.15 23.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.856 0.836 . . . . 25.0 109.183 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -131.23 135.0 47.0 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.415 -0.587 . . . . 25.0 109.415 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -87.72 -11.98 46.63 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.391 0.515 . . . . 25.0 112.391 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.54 160.72 32.2 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.665 0.617 . . . . 25.0 112.665 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 155.96 39.75 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 116.101 1.889 . . . . 25.0 116.101 -171.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.7 t -102.55 159.24 15.62 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.973 -1.121 . . . . 25.0 107.973 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.3 t -117.9 -14.73 10.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.069 0.396 . . . . 25.0 112.069 172.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.3 t -171.23 153.61 3.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.022 0.439 . . . . 25.0 112.179 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -127.9 139.14 52.78 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 169.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -146.72 152.73 39.29 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.361 -0.977 . . . . 25.0 108.361 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -137.98 135.76 36.3 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.41 -1.7 . . . . 25.0 106.41 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.28 163.36 37.9 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.93 165.77 31.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 113.694 0.998 . . . . 25.0 113.694 -167.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.4 p -79.69 162.52 25.16 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 169.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -62.78 159.14 47.03 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.474 -0.784 . . . . 25.0 108.963 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.13 -25.54 31.42 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 116.194 -2.071 . . . . 25.0 113.985 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -113.93 32.03 6.14 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 122.811 0.444 . . . . 25.0 110.736 -175.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.2 p-90 -71.7 166.62 21.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.958 0.885 . . . . 25.0 112.818 -176.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.87 101.0 10.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.658 -1.155 . . . . 25.0 109.504 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -91.59 12.95 19.29 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 116.706 2.113 . . . . 25.0 116.706 -168.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.1 t -125.51 12.44 8.07 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.252 -1.018 . . . . 25.0 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.9 mp0 -114.09 157.12 43.02 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.374 -1.285 . . . . 25.0 107.886 -174.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.36 153.16 79.07 Favored 'Trans proline' 0 CA--C 1.533 0.451 0 O-C-N 121.953 0.449 . . . . 25.0 111.59 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 102.56 2.89 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.383 0.611 . . . . 25.0 111.932 -176.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.1 p -89.13 156.54 18.75 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.154 -1.054 . . . . 25.0 108.154 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -65.56 -25.89 67.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.265 0.555 . . . . 25.0 110.85 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.44 60.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.816 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.5 t -78.76 -7.68 58.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.37 0.507 . . . . 25.0 112.37 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -101.63 158.05 16.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.469 1.285 . . . . 25.0 114.469 -175.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -95.72 95.42 8.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 102.655 -3.091 . . . . 25.0 102.655 162.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.1 mt -66.15 -7.58 18.82 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.832 1.419 . . . . 25.0 114.832 -169.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.66 120.25 76.16 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 176.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.52 142.19 43.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.368 -2.621 . . . . 25.0 111.666 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -92.27 -12.31 32.92 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.249 0.462 . . . . 25.0 112.249 -175.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 69.3 m -148.05 64.71 1.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.367 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -88.93 130.97 35.34 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 118.496 -1.282 . . . . 25.0 109.062 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -119.79 99.08 6.42 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 103.689 -2.708 . . . . 25.0 103.689 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -94.02 91.83 7.05 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.6 118.84 37.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 104.424 -2.436 . . . . 25.0 104.424 173.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.35 81.8 0.41 Allowed Glycine 0 CA--C 1.502 -0.758 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.423 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.79 14.81 4.59 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.973 -0.632 . . . . 25.0 113.168 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.86 106.16 5.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.591 0.71 . . . . 25.0 109.691 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.6 123.94 90.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 105.353 -2.092 . . . . 25.0 105.353 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.79 168.87 23.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 N-CA-C 113.765 0.641 . . . . 25.0 113.765 -174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.459 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.82 26.77 4.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.51 -17.05 0.29 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 125.823 1.649 . . . . 25.0 112.188 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.9 mt-30 -128.21 153.13 47.26 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.034 -2.58 . . . . 25.0 104.034 169.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.8 t -142.82 95.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.2 t -94.01 126.64 39.35 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.74 166.99 21.68 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.416 -2.068 . . . . 25.0 105.416 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -130.71 154.39 48.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.581 -2.007 . . . . 25.0 105.581 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.63 160.19 36.24 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.628 -1.249 . . . . 25.0 107.628 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -104.38 116.43 32.12 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.192 0.307 . . . . 25.0 111.346 -176.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.4 mt -77.29 132.4 70.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.121 -1.066 . . . . 25.0 108.121 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -61.14 146.43 97.59 Favored 'Trans proline' 0 C--N 1.354 0.846 0 CA-C-O 121.655 0.606 . . . . 25.0 113.547 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.85 -26.11 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.197 -0.91 . . . . 25.0 112.802 -168.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.9 p-10 -84.16 9.69 12.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.545 0.688 . . . . 25.0 110.153 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.2 53.39 0.83 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.76 0.791 . . . . 25.0 108.977 172.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -86.04 169.32 13.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.409 -1.33 . . . . 25.0 107.409 175.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.75 -167.72 37.04 Favored Glycine 0 N--CA 1.451 -0.338 0 N-CA-C 115.733 1.053 . . . . 25.0 115.733 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -85.95 107.81 17.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.534 0.683 . . . . 25.0 110.478 -169.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 45.7 p-80 -157.21 171.92 19.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.678 -0.692 . . . . 25.0 110.512 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.9 p -108.03 150.64 10.54 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.125 -1.065 . . . . 25.0 108.125 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.8 mt -132.04 122.7 49.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 104.247 -2.501 . . . . 25.0 104.247 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.6 mp -105.05 127.68 52.99 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.588 -0.733 . . . . 25.0 110.004 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.16 127.59 55.98 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.851 -0.796 . . . . 25.0 108.851 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.63 140.62 46.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 122.075 0.94 . . . . 25.0 112.016 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -117.77 119.4 34.79 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.09 124.18 42.49 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.673 -0.862 . . . . 25.0 108.673 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.9 mm -76.75 141.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.084 -0.71 . . . . 25.0 109.084 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.69 -44.96 22.41 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.192 0.905 . . . . 25.0 110.482 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.14 -21.35 64.93 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -171.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 56.1 p -138.45 169.53 17.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.85 0.833 . . . . 25.0 109.765 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.66 23.2 0.54 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.284 -0.871 . . . . 25.0 112.107 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -94.94 144.12 25.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.36 143.77 16.64 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 104.513 -2.402 . . . . 25.0 104.513 172.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -145.87 134.87 22.62 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.739 0.644 . . . . 25.0 112.739 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.76 113.94 26.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.492 -0.776 . . . . 25.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.02 108.0 20.64 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.04 141.9 31.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.461 -0.79 . . . . 25.0 111.511 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.0 tt -125.37 133.84 68.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.478 -2.045 . . . . 25.0 105.478 167.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -93.7 131.26 39.2 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.1 m -132.59 161.07 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -175.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -117.64 95.02 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 103.67 -2.715 . . . . 25.0 103.67 167.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.57 163.82 14.44 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.027 -0.533 . . . . 25.0 112.29 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.7 p -145.68 163.37 35.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.015 -1.106 . . . . 25.0 108.015 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.403 ' C ' ' HZ2' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 CA-C-O 118.085 -0.96 . . . . 25.0 110.821 -178.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 m80 . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 110.294 -0.262 . . . . 25.0 110.294 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 142.78 169.74 12.47 Favored Glycine 0 C--O 1.229 -0.199 0 N-CA-C 103.283 -3.927 . . . . 25.0 103.283 -173.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -146.14 167.87 22.38 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.886 1.843 . . . . 25.0 109.793 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.92 125.11 64.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 107.103 -1.443 . . . . 25.0 107.103 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.93 -42.6 48.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.945 -1.025 . . . . 25.0 109.951 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.3 t -153.59 129.49 5.28 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 105.755 -1.943 . . . . 25.0 105.755 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -64.24 131.95 12.68 Favored 'Cis proline' 0 CA--C 1.533 0.432 0 C-N-CA 128.774 0.739 . . . . 25.0 111.373 -0.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.54 109.96 3.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.016 -0.538 . . . . 25.0 111.477 -173.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -72.0 162.42 29.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.559 -0.534 . . . . 25.0 109.559 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -60.0 -22.28 62.38 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.089 0.471 . . . . 25.0 111.765 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.53 19.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.809 -0.812 . . . . 25.0 108.809 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -64.93 -37.76 88.71 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.659 -0.7 . . . . 25.0 110.411 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -63.06 -32.14 73.44 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.311 -0.243 . . . . 25.0 111.058 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -39.62 92.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.051 0.453 . . . . 25.0 110.325 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -69.84 -34.22 73.35 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.168 0.509 . . . . 25.0 109.975 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -75.16 2.88 9.75 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.374 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.71 10.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.405 1.482 . . . . 25.0 112.778 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.454 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.6 mt -86.85 -21.71 26.23 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.335 -1.357 . . . . 25.0 107.335 173.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.454 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 157.35 32.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.337 -2.097 . . . . 25.0 105.337 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.2 p -135.6 176.21 8.88 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.987 -0.375 . . . . 25.0 109.987 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 72.15 5.29 5.27 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.096 1.517 . . . . 25.0 115.096 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -69.13 -39.7 78.71 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 121.734 -0.604 . . . . 25.0 110.908 173.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.99 -63.76 2.0 Favored Glycine 0 C--O 1.217 -0.908 0 N-CA-C 111.831 -0.508 . . . . 25.0 111.831 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.3 p -87.98 -52.98 4.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.466 1.127 . . . . 25.0 111.953 -178.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -68.2 -11.61 14.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.324 -1.307 . . . . 25.0 112.708 -171.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.22 -0.76 57.21 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.918 -0.489 . . . . 25.0 111.896 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -117.12 -35.44 4.07 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.679 -0.809 . . . . 25.0 109.845 172.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -127.04 94.8 38.38 Favored Pre-proline 0 CA--C 1.543 0.68 0 N-CA-C 111.797 0.295 . . . . 25.0 111.797 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -71.83 -19.92 26.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 N-CA-C 115.111 1.158 . . . . 25.0 115.111 -177.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.54 9.3 13.92 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 121.804 -0.56 . . . . 25.0 112.219 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.8 m -67.61 -14.67 63.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.7 m -64.11 131.9 29.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.238 0.829 . . . . 25.0 113.238 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -152.94 149.21 27.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.266 -1.012 . . . . 25.0 108.266 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.71 -168.3 17.83 Favored Glycine 0 N--CA 1.452 -0.233 0 N-CA-C 109.503 -1.439 . . . . 25.0 109.503 -178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.92 149.78 49.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.732 0.766 . . . . 25.0 111.213 -177.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.53 156.89 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.217 -1.401 . . . . 25.0 107.217 171.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.52 -0.14 3.4 Favored Glycine 0 C--N 1.318 -0.462 0 CA-C-N 115.099 -0.955 . . . . 25.0 113.373 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -75.93 146.44 79.24 Favored Pre-proline 0 C--N 1.321 -0.653 0 O-C-N 121.678 -0.895 . . . . 25.0 108.669 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.56 -16.97 16.52 Favored 'Cis proline' 0 CA--C 1.542 0.907 0 N-CA-C 115.834 1.436 . . . . 25.0 115.834 -5.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -74.09 -36.91 64.29 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.343 1.238 . . . . 25.0 114.343 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -111.63 32.86 5.11 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.322 -2.103 . . . . 25.0 105.322 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.29 -177.38 47.31 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.375 -1.284 . . . . 25.0 110.67 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -62.85 172.75 4.41 Favored 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 122.812 2.342 . . . . 25.0 113.784 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.08 30.96 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 106.44 -1.689 . . . . 25.0 106.44 173.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 139.47 58.05 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.489 -1.232 . . . . 25.0 108.072 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.89 -2.82 87.05 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 121.487 -0.387 . . . . 25.0 112.614 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.421 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 47.2 m170 -125.82 9.79 7.63 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.277 -0.543 . . . . 25.0 110.348 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.0 mt -66.29 -45.27 90.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 O-C-N 122.028 -0.42 . . . . 25.0 111.04 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.12 -23.43 57.89 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.863 -0.523 . . . . 25.0 109.882 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.0 p -82.83 -7.53 59.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.57 35.19 17.33 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.568 0.747 . . . . 25.0 110.499 -173.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.421 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 60.63 36.04 19.75 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -177.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -118.71 131.25 56.14 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 122.067 -0.395 . . . . 25.0 110.65 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -61.61 -32.28 72.4 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 113.922 1.082 . . . . 25.0 113.922 -176.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -9.98 55.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.821 0.674 . . . . 25.0 112.821 -178.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 11.4 m-85 -121.7 16.37 11.09 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.79 -36.19 67.55 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.172 -0.955 . . . . 25.0 110.605 -177.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 mp0 -70.76 -16.63 62.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.088 0.947 . . . . 25.0 108.906 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.6 mp -88.85 -2.36 58.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.095 -0.957 . . . . 25.0 108.902 -178.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -112.1 -31.98 6.71 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -96.07 118.17 32.13 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.731 -0.606 . . . . 25.0 110.55 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.46 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.78 161.05 26.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.64 -0.709 . . . . 25.0 109.598 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 4.1 p -117.2 162.34 28.45 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 100.572 -3.862 . . . . 25.0 100.572 163.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.28 -4.96 14.75 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 116.756 -1.696 . . . . 25.0 115.972 -174.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -127.88 13.63 6.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.81 0.814 . . . . 25.0 111.022 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -77.81 -29.14 50.58 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.37 -0.831 . . . . 25.0 112.55 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.46 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.0 m95 -127.54 168.16 15.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 110.068 -0.345 . . . . 25.0 110.068 -178.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -67.94 120.94 15.03 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 106.6 -1.63 . . . . 25.0 106.6 171.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -95.8 104.76 16.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 100.358 -3.942 . . . . 25.0 100.358 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.83 134.95 53.14 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 114.857 -1.065 . . . . 25.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.05 99.86 12.79 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.56 -1.2 . . . . 25.0 107.925 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.3 mt -131.89 173.92 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 105.759 -1.941 . . . . 25.0 105.759 -176.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -116.51 168.95 9.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.576 0.703 . . . . 25.0 112.57 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.4 p -77.15 173.07 12.26 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 106.365 -1.717 . . . . 25.0 106.365 173.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.07 -162.23 33.64 Favored Glycine 0 C--O 1.241 0.546 0 C-N-CA 120.388 -0.911 . . . . 25.0 111.027 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.97 131.28 40.81 Favored 'Trans proline' 0 C--N 1.345 0.366 0 CA-C-N 118.869 1.334 . . . . 25.0 114.766 -175.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -138.17 161.39 36.95 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.8 p -104.85 152.03 23.11 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -139.31 101.01 4.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.969 -1.863 . . . . 25.0 105.969 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.91 110.16 22.2 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 122.063 0.935 . . . . 25.0 110.54 -178.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -93.96 147.69 22.87 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.28 -0.873 . . . . 25.0 110.113 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -125.34 110.13 13.62 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.741 -2.318 . . . . 25.0 104.741 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.0 mp -102.93 128.74 49.6 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.481 -0.782 . . . . 25.0 110.865 -171.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.8 t -85.58 3.9 38.59 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.105 0.479 . . . . 25.0 111.764 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.8 143.24 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.596 -0.52 . . . . 25.0 109.596 -177.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -84.13 -2.42 56.76 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.983 0.735 . . . . 25.0 112.983 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.97 158.76 24.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.075 0.769 . . . . 25.0 113.075 -176.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.7 t -75.78 155.97 34.98 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.367 1.247 . . . . 25.0 114.367 -172.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.5 t -103.37 155.98 18.08 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.6 -0.727 . . . . 25.0 109.615 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.4 t -117.79 -16.96 9.94 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 111.741 0.275 . . . . 25.0 111.741 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -171.34 154.31 3.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.069 0.461 . . . . 25.0 112.006 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -127.75 142.14 51.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 104.129 -2.545 . . . . 25.0 104.129 168.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -147.42 154.66 41.12 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.121 0.873 . . . . 25.0 108.93 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -137.91 139.01 39.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.888 -1.523 . . . . 25.0 106.888 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -148.9 164.33 34.82 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.573 0.624 . . . . 25.0 110.167 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.11 166.45 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -167.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 p -81.23 164.25 22.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.76 157.06 51.66 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.22 -0.9 . . . . 25.0 109.716 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -68.83 -20.07 39.94 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.891 -0.94 . . . . 25.0 114.535 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -120.96 32.02 6.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.228 0.455 . . . . 25.0 112.228 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.3 p-90 -74.95 164.86 26.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.694 0.759 . . . . 25.0 111.71 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -86.64 100.99 12.84 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.979 -1.01 . . . . 25.0 110.28 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -81.24 23.28 0.6 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 116.12 1.896 . . . . 25.0 116.12 -172.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 8.6 t -125.84 2.86 7.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.318 0.58 . . . . 25.0 110.482 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -108.69 157.02 37.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.329 -0.85 . . . . 25.0 109.477 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.4 153.21 78.13 Favored 'Trans proline' 0 C--N 1.348 0.539 0 O-C-N 121.943 0.444 . . . . 25.0 111.587 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 104.83 3.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.441 0.638 . . . . 25.0 112.313 -175.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.8 p -95.25 156.8 16.17 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 176.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -67.4 -25.17 65.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.3 0.571 . . . . 25.0 110.635 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.17 -25.13 63.29 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.277 -0.874 . . . . 25.0 111.858 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.4 t -85.05 -5.11 59.36 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.954 0.407 . . . . 25.0 111.807 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -103.11 153.83 19.91 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 114.993 1.479 . . . . 25.0 114.993 -174.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.35 90.02 4.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 102.604 -3.11 . . . . 25.0 102.604 163.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.0 -6.39 12.61 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.934 1.457 . . . . 25.0 114.934 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.2 t -80.13 132.68 59.17 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.165 -0.68 . . . . 25.0 109.165 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.8 149.8 48.72 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 114.94 -2.907 . . . . 25.0 110.82 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -102.63 -9.84 19.76 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.969 0.414 . . . . 25.0 111.425 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 54.5 m -150.36 67.89 0.97 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.451 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -89.02 132.88 34.55 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 118.87 -1.132 . . . . 25.0 108.788 175.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -121.68 99.06 6.25 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 104.166 -2.531 . . . . 25.0 104.166 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -89.65 92.11 8.94 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.134 -1.062 . . . . 25.0 108.134 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -109.17 118.28 36.33 Favored 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 107.428 -1.323 . . . . 25.0 107.428 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.69 80.87 0.42 Allowed Glycine 0 CA--C 1.501 -0.795 0 CA-C-N 115.568 -0.742 . . . . 25.0 112.963 -170.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.6 16.94 6.74 Favored Glycine 0 C--N 1.321 -0.289 0 C-N-CA 120.793 -0.717 . . . . 25.0 114.296 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.15 104.88 3.2 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.2 mt -68.68 122.33 84.37 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.27 170.54 19.34 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 117.748 -1.035 . . . . 25.0 113.694 -175.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.84 29.09 6.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.356 -0.979 . . . . 25.0 108.356 176.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.16 -15.67 0.33 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.693 1.597 . . . . 25.0 112.152 -174.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.461 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.1 mt-30 -128.59 152.47 48.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 103.598 -2.742 . . . . 25.0 103.598 170.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.3 t -141.38 95.11 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 107.013 -1.477 . . . . 25.0 107.013 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -84.92 134.72 34.25 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 105.514 -2.032 . . . . 25.0 105.514 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.47 165.77 26.35 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 105.626 -1.99 . . . . 25.0 105.626 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -135.5 152.22 51.12 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 104.705 -2.331 . . . . 25.0 104.705 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.87 160.24 30.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.38 -1.341 . . . . 25.0 107.38 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -103.44 118.87 37.74 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.111 0.257 . . . . 25.0 110.924 -177.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.0 mt -76.87 132.57 71.11 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.06 146.25 96.25 Favored 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-O 121.818 0.674 . . . . 25.0 113.456 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.75 -25.18 44.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.991 -1.004 . . . . 25.0 112.721 -169.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -84.48 7.98 18.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.682 -0.69 . . . . 25.0 110.119 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.6 mmt-85 -115.64 55.12 0.79 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 108.41 -0.959 . . . . 25.0 108.41 172.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.6 p -86.02 170.99 11.76 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.176 -1.787 . . . . 25.0 106.176 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.09 -169.53 44.15 Favored Glycine 0 C--N 1.32 -0.311 0 N-CA-C 115.64 1.016 . . . . 25.0 115.64 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.9 t -86.06 113.6 22.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.314 0.578 . . . . 25.0 110.86 -169.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.43 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 52.4 p-80 -159.92 171.78 18.79 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.956 -0.566 . . . . 25.0 111.049 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.6 p -105.01 151.16 7.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.348 -1.353 . . . . 25.0 107.348 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -134.63 128.33 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 102.475 -3.157 . . . . 25.0 102.475 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.8 mp -113.12 131.74 55.72 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 116.067 -0.515 . . . . 25.0 109.659 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.73 131.22 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 25.0 109.565 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -127.55 142.91 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 122.064 0.935 . . . . 25.0 112.525 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -115.57 119.66 36.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.84 -1.527 . . . . 25.0 107.104 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.91 121.89 39.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.086 -1.079 . . . . 25.0 108.086 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 13.1 mm -77.66 143.2 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.002 -0.74 . . . . 25.0 109.002 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.63 -42.9 27.56 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.971 0.805 . . . . 25.0 109.792 175.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.01 -23.7 65.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 114.075 1.139 . . . . 25.0 114.075 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 45.4 p -139.02 168.82 18.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.967 0.889 . . . . 25.0 110.374 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.4 18.7 1.09 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.181 -0.918 . . . . 25.0 112.246 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -90.06 146.59 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.71 138.6 10.83 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.797 -1.927 . . . . 25.0 105.797 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -138.79 132.97 31.49 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.126 0.421 . . . . 25.0 112.032 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -93.18 115.03 27.67 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.653 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -97.05 112.63 24.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.204 -0.665 . . . . 25.0 109.204 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.1 139.12 37.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.915 -0.584 . . . . 25.0 112.163 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -126.45 135.24 64.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.327 -2.101 . . . . 25.0 105.327 166.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -93.67 132.67 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.614 -1.254 . . . . 25.0 107.614 176.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -133.23 161.69 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.539 0.57 . . . . 25.0 112.539 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -120.98 95.04 4.54 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.784 -2.302 . . . . 25.0 104.784 170.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.7 tp -93.53 160.0 14.98 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 114.157 1.169 . . . . 25.0 114.157 -170.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.3 p -145.9 173.03 12.5 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.567 -0.531 . . . . 25.0 109.567 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.74 0 N-CA-C 108.609 -0.886 . . . . 25.0 108.609 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 15.8 m170 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 121.304 0.573 . . . . 25.0 110.752 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.65 167.52 35.38 Favored Glycine 0 C--N 1.322 -0.218 1 N-CA-C 102.147 -4.381 . . . . 25.0 102.147 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -146.1 166.49 25.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 120.071 1.936 . . . . 25.0 109.915 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.89 124.03 63.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.814 -1.18 . . . . 25.0 107.814 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -40.53 56.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.767 -1.106 . . . . 25.0 110.384 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -153.28 128.21 4.81 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -65.55 134.59 21.38 Favored 'Cis proline' 0 C--N 1.347 0.482 0 CA-C-N 118.814 0.612 . . . . 25.0 110.88 -0.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.09 4.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.105 -0.498 . . . . 25.0 111.079 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.7 p -72.13 164.41 26.23 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -59.55 -22.46 61.73 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.183 0.516 . . . . 25.0 111.777 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.71 -52.93 25.55 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.05 -0.722 . . . . 25.0 109.05 175.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -67.37 -35.07 78.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.019 -0.537 . . . . 25.0 110.928 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -63.97 -32.15 73.58 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.061 -0.4 . . . . 25.0 110.739 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -40.48 96.44 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.418 0.628 . . . . 25.0 109.496 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.58 -34.31 76.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.022 -0.535 . . . . 25.0 110.362 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.5 mt -79.78 5.3 13.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.575 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.49 23.02 10.28 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.029 1.331 . . . . 25.0 113.233 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.459 ' C ' HD21 ' A' ' 19' ' ' ASN . 96.0 mt -88.18 -21.03 24.8 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.741 -1.207 . . . . 25.0 107.741 174.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.459 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.62 159.53 29.07 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 105.148 -2.168 . . . . 25.0 105.148 176.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.4 p -135.16 175.64 9.4 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 122.215 0.206 . . . . 25.0 110.517 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 71.46 5.06 5.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.75 1.759 . . . . 25.0 115.75 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -68.26 -38.95 82.28 Favored 'General case' 0 CA--C 1.501 -0.92 0 O-C-N 121.53 -0.731 . . . . 25.0 111.392 175.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.95 -64.21 1.57 Allowed Glycine 0 C--O 1.218 -0.869 0 O-C-N 123.575 0.547 . . . . 25.0 112.087 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -87.98 -53.29 4.81 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.581 1.181 . . . . 25.0 111.599 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.13 -7.97 9.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.017 -172.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.83 2.74 53.11 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.825 -0.547 . . . . 25.0 111.527 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -119.72 -33.98 3.88 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.949 -0.7 . . . . 25.0 109.98 172.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -126.98 103.9 23.34 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 110.102 -0.333 . . . . 25.0 110.102 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.98 -21.11 21.2 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.034 -1.511 . . . . 25.0 114.678 -175.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.99 12.89 6.72 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.0 m -66.79 -13.77 61.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.829 0.307 . . . . 25.0 111.829 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.469 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 27.8 m -65.72 135.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 113.654 0.983 . . . . 25.0 113.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -153.06 151.55 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -157.92 -172.08 24.65 Favored Glycine 0 C--N 1.328 0.115 0 N-CA-C 110.575 -1.01 . . . . 25.0 110.575 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 tp -127.62 148.29 50.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.011 0.906 . . . . 25.0 112.011 -177.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.63 156.97 33.69 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.008 -1.108 . . . . 25.0 108.008 172.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 134.85 2.36 3.14 Favored Glycine 0 C--O 1.224 -0.489 0 CA-C-N 114.832 -1.076 . . . . 25.0 113.285 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -75.78 141.44 72.06 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 121.536 -0.979 . . . . 25.0 109.757 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -92.07 -18.37 12.98 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 N-CA-C 115.899 1.461 . . . . 25.0 115.899 -5.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -73.13 -35.19 66.47 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.043 1.497 . . . . 25.0 115.043 -168.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.93 38.23 3.72 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.16 -2.163 . . . . 25.0 105.16 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -111.9 -171.77 18.93 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 114.345 -1.298 . . . . 25.0 110.444 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.74 167.27 10.43 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.19 1.926 . . . . 25.0 114.739 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.02 159.97 31.09 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.727 -1.583 . . . . 25.0 106.727 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.11 139.24 57.62 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.287 -1.324 . . . . 25.0 108.914 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.49 -2.91 84.27 Favored Glycine 0 C--O 1.225 -0.415 0 CA-C-N 116.038 -0.528 . . . . 25.0 112.806 -175.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -124.5 11.73 8.63 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.473 -0.936 . . . . 25.0 108.473 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 59.5 mt -65.21 -54.35 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 112.61 0.596 . . . . 25.0 112.61 -171.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.26 -20.17 60.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.874 0.845 . . . . 25.0 108.798 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 t -74.56 -16.26 60.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.962 . . . . 25.0 111.792 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 55.26 26.24 8.3 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.38 0.672 . . . . 25.0 109.94 -172.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.57 35.78 22.66 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.781 1.232 . . . . 25.0 114.106 -176.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -122.3 133.97 54.67 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.183 0.593 . . . . 25.0 111.051 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -59.87 -31.96 70.26 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 115.092 1.515 . . . . 25.0 115.092 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.09 -10.25 58.13 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.191 0.441 . . . . 25.0 112.191 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.469 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 8.4 m-85 -123.63 16.23 9.54 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -71.12 -41.59 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.058 -1.026 . . . . 25.0 111.613 -174.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -73.43 -11.09 60.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.717 0.77 . . . . 25.0 109.722 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -84.26 -6.61 59.42 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -114.83 -34.96 4.95 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.638 0.607 . . . . 25.0 112.638 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -89.42 113.5 24.85 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.651 -0.656 . . . . 25.0 111.094 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.459 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.0 pm0 -121.92 160.99 23.64 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.661 -0.7 . . . . 25.0 109.376 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -119.97 163.88 25.49 Favored Pre-proline 0 C--N 1.317 -0.825 1 N-CA-C 99.95 -4.093 . . . . 25.0 99.95 162.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.92 -5.78 17.11 Favored 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 116.196 -2.069 . . . . 25.0 115.669 -175.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -121.41 9.78 10.39 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.712 0.768 . . . . 25.0 111.115 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -77.78 -28.72 50.61 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.39 -0.819 . . . . 25.0 113.013 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.459 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 13.0 m95 -127.21 167.61 15.84 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.87 0.367 . . . . 25.0 111.717 -177.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -67.75 119.12 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 106.124 -1.806 . . . . 25.0 106.124 167.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -92.54 104.25 16.57 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 100.934 -3.728 . . . . 25.0 100.934 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.75 135.34 54.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.589 -1.187 . . . . 25.0 110.165 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -93.33 102.2 14.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.733 -1.121 . . . . 25.0 108.187 -177.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.6 mt -130.01 173.99 10.2 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.001 -1.111 . . . . 25.0 108.001 -176.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.46 156.89 26.05 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.55 -0.75 . . . . 25.0 111.562 -175.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.1 p -77.17 166.26 23.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.95 -1.5 . . . . 25.0 106.95 173.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.03 -164.5 21.57 Favored Glycine 0 C--O 1.239 0.454 0 N-CA-C 110.677 -0.969 . . . . 25.0 110.677 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.38 134.2 59.83 Favored 'Trans proline' 0 C--N 1.346 0.417 0 CA-C-N 118.972 1.386 . . . . 25.0 114.278 -177.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -140.84 161.66 37.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.309 -1.738 . . . . 25.0 106.309 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.2 p -105.4 152.12 23.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.837 -1.172 . . . . 25.0 107.837 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -139.45 101.02 4.13 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 105.967 -1.864 . . . . 25.0 105.967 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.39 108.77 20.15 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.79 0.805 . . . . 25.0 110.341 -178.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -97.75 148.67 23.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.602 -0.726 . . . . 25.0 110.094 -178.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -127.25 116.33 20.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 104.205 -2.517 . . . . 25.0 104.205 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -112.26 119.22 37.59 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.455 -0.793 . . . . 25.0 110.573 -173.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.01 18.58 3.48 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.507 0.67 . . . . 25.0 110.999 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.11 138.23 36.86 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.509 -0.552 . . . . 25.0 109.509 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -86.07 -7.15 58.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.488 0.922 . . . . 25.0 113.488 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.57 154.49 32.48 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.457 0.54 . . . . 25.0 112.457 -176.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.9 t -72.7 155.94 39.47 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -173.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.419 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.7 t -97.97 158.35 15.59 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 173.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.7 -14.98 10.17 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.041 0.213 . . . . 25.0 111.182 171.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -173.28 153.3 2.4 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.866 0.365 . . . . 25.0 111.826 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.07 139.08 54.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.225 -2.509 . . . . 25.0 104.225 166.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -143.08 148.18 36.24 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -137.92 132.36 32.29 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -149.52 164.01 36.25 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.65 0.659 . . . . 25.0 110.517 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.29 164.12 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -167.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.6 p -77.89 163.5 25.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.18 155.15 47.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.221 -0.899 . . . . 25.0 109.703 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -68.87 -23.01 35.56 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 117.404 -1.264 . . . . 25.0 113.633 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -113.09 32.07 5.99 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.607 0.363 . . . . 25.0 111.476 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.507 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 3.8 p-90 -82.28 163.06 22.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.674 0.75 . . . . 25.0 111.044 -177.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -93.28 100.98 13.23 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.096 -0.956 . . . . 25.0 110.574 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.507 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -74.01 19.92 0.11 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.817 1.784 . . . . 25.0 115.817 -175.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -112.52 -6.28 13.97 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 174.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -100.25 157.09 34.45 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.449 -0.796 . . . . 25.0 109.286 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 159.08 54.03 Favored 'Trans proline' 0 C--N 1.346 0.426 0 O-C-N 121.962 0.453 . . . . 25.0 112.241 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.98 99.95 1.89 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.076 0.465 . . . . 25.0 111.115 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.6 p -99.14 154.65 17.97 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.604 -0.887 . . . . 25.0 108.604 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -65.59 -25.62 67.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.255 0.55 . . . . 25.0 110.635 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.18 -25.19 63.31 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 25.0 111.973 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 30.8 t -89.6 -3.1 58.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.819 0.343 . . . . 25.0 111.597 -178.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -101.09 152.38 20.68 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.903 1.075 . . . . 25.0 113.903 -175.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -100.16 95.23 6.68 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 103.108 -2.923 . . . . 25.0 103.108 164.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -67.65 -6.4 20.32 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.195 1.183 . . . . 25.0 114.195 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.16 125.36 85.22 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 109.12 -0.696 . . . . 25.0 109.12 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -72.86 148.57 46.14 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 115.14 -2.773 . . . . 25.0 111.554 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -100.64 -14.77 18.0 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.5 m -147.35 64.42 1.15 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.568 -0.287 . . . . 25.0 111.101 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -89.08 138.59 31.28 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.457 -1.297 . . . . 25.0 108.825 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.59 99.54 6.05 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 103.552 -2.759 . . . . 25.0 103.552 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -92.09 91.87 8.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.692 -1.225 . . . . 25.0 107.692 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -110.25 118.03 35.26 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.67 80.46 0.46 Allowed Glycine 0 CA--C 1.502 -0.744 0 CA-C-N 115.459 -0.791 . . . . 25.0 113.791 -169.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.34 18.9 6.02 Favored Glycine 0 C--N 1.321 -0.263 0 C-N-CA 120.941 -0.647 . . . . 25.0 113.443 178.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.86 106.89 6.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.614 0.721 . . . . 25.0 109.427 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.1 mt -70.73 122.7 87.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 105.834 -1.913 . . . . 25.0 105.834 176.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.5 169.24 21.39 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 118.125 -0.783 . . . . 25.0 113.94 -174.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.427 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -95.0 22.54 6.46 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.852 -0.613 . . . . 25.0 109.542 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.55 -17.46 0.28 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 125.716 1.607 . . . . 25.0 112.739 -176.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.8 mt-30 -128.96 150.06 50.55 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 103.172 -2.899 . . . . 25.0 103.172 168.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.9 t -140.33 94.99 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 38.1 m -89.64 121.5 31.88 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 174.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -132.33 166.95 20.76 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.63 -1.248 . . . . 25.0 107.63 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -132.83 155.73 48.45 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.432 -1.692 . . . . 25.0 106.432 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.48 160.53 23.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 47.7 m-20 -103.94 119.69 39.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.466 0.174 . . . . 25.0 110.57 -177.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.1 mt -76.69 131.06 74.69 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 107.117 -1.438 . . . . 25.0 107.117 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.65 145.92 91.88 Favored 'Trans proline' 0 C--N 1.352 0.751 0 CA-C-O 121.668 0.612 . . . . 25.0 113.384 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.83 -26.48 40.45 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.316 -0.856 . . . . 25.0 112.625 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -82.38 7.11 14.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.6 -0.727 . . . . 25.0 110.275 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -118.59 51.82 1.07 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.268 -1.012 . . . . 25.0 108.268 172.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 9.3 p -85.89 170.99 11.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 106.086 -1.82 . . . . 25.0 106.086 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.01 -171.34 37.2 Favored Glycine 0 N--CA 1.452 -0.259 0 N-CA-C 115.444 0.937 . . . . 25.0 115.444 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.2 t -86.05 109.68 18.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.391 0.615 . . . . 25.0 110.512 -169.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.41 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.3 p-80 -158.26 171.06 20.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.974 -0.557 . . . . 25.0 111.941 -175.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.6 p -104.2 150.58 7.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.1 mt -133.25 121.92 43.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.6 132.91 52.06 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.608 -0.724 . . . . 25.0 109.78 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.25 135.23 53.27 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.193 -0.669 . . . . 25.0 109.193 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.98 144.6 37.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.922 0.868 . . . . 25.0 112.531 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.419 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 13.3 t90 -113.28 112.37 23.6 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.121 -1.807 . . . . 25.0 106.121 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -92.62 125.23 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.0 mm -81.46 141.53 15.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 109.578 -0.527 . . . . 25.0 109.578 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.46 -43.05 24.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.868 0.758 . . . . 25.0 110.409 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -23.92 64.69 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.611 0.967 . . . . 25.0 113.611 -172.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.4 p -138.86 169.99 16.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.912 0.863 . . . . 25.0 109.91 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.05 20.32 0.81 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.223 -0.899 . . . . 25.0 112.189 178.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -90.01 145.9 24.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.592 -0.693 . . . . 25.0 112.731 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.66 136.81 7.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.343 -1.725 . . . . 25.0 106.343 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -137.87 130.33 29.39 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.482 0.549 . . . . 25.0 112.482 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.07 117.59 28.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.65 -0.704 . . . . 25.0 110.605 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -97.13 115.91 28.39 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.801 -1.185 . . . . 25.0 107.801 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.95 142.97 27.59 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.8 136.7 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 104.505 -2.405 . . . . 25.0 104.505 166.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -99.47 129.83 45.68 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.0 m -133.5 162.19 40.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -116.03 95.05 4.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.912 -2.625 . . . . 25.0 103.912 166.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.77 163.09 14.59 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.104 -0.498 . . . . 25.0 112.164 -172.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.6 p -145.98 162.68 37.29 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.847 -0.797 . . . . 25.0 108.847 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.751 0 CA-C-O 118.005 -0.998 . . . . 25.0 111.05 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 m170 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.258 0.552 . . . . 25.0 110.967 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.54 169.98 40.01 Favored Glycine 0 CA--C 1.509 -0.333 1 N-CA-C 102.839 -4.104 . . . . 25.0 102.839 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -145.13 167.28 23.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.891 1.845 . . . . 25.0 109.3 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.75 124.67 64.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.477 -0.935 . . . . 25.0 108.477 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -75.2 -43.5 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.661 -1.154 . . . . 25.0 109.96 -175.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.5 t -152.74 129.27 5.43 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 105.798 -1.927 . . . . 25.0 105.798 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -64.77 132.87 15.45 Favored 'Cis proline' 0 C--N 1.346 0.4 0 CA-C-N 118.791 0.604 . . . . 25.0 110.895 -0.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 109.67 2.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.039 -0.528 . . . . 25.0 111.953 -172.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 t -72.01 157.71 37.32 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -55.25 -25.25 32.46 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.562 0.745 . . . . 25.0 111.828 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.16 -53.52 36.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.659 0.742 . . . . 25.0 109.431 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -67.75 -35.04 78.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.714 -0.675 . . . . 25.0 110.626 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -63.56 -32.35 73.79 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 122.076 -0.39 . . . . 25.0 110.344 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -39.06 92.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 25.0 110.031 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.73 -35.81 79.43 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.058 -0.519 . . . . 25.0 109.821 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.7 mt -77.91 3.54 14.27 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.179 -0.464 . . . . 25.0 111.623 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 57.92 21.98 8.24 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.242 1.417 . . . . 25.0 113.245 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.457 ' C ' HD21 ' A' ' 19' ' ' ASN . 95.6 mt -84.05 -21.37 31.6 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 172.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.457 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.78 158.59 31.41 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.812 -2.292 . . . . 25.0 104.812 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.6 p -136.6 176.02 9.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.918 -0.401 . . . . 25.0 109.918 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 71.97 5.21 5.28 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.516 1.672 . . . . 25.0 115.516 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 78.6 m -68.54 -36.7 79.17 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 121.585 -0.697 . . . . 25.0 111.154 174.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -62.96 1.45 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.681 0.613 . . . . 25.0 112.378 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.3 t -87.97 -53.74 4.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 122.564 1.173 . . . . 25.0 111.868 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.2 t -67.36 -12.37 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.41 -1.268 . . . . 25.0 113.116 -171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -87.02 -2.26 58.5 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 121.808 -0.557 . . . . 25.0 111.75 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -117.26 -34.53 4.31 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 119.744 -0.782 . . . . 25.0 110.424 172.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -127.04 98.52 30.21 Favored Pre-proline 0 C--O 1.24 0.597 0 N-CA-C 110.414 -0.217 . . . . 25.0 110.414 170.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.83 -20.68 22.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 116.976 -1.549 . . . . 25.0 114.734 -174.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -82.88 8.83 11.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.845 -0.534 . . . . 25.0 112.384 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m -67.68 -14.65 63.12 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.553 0.575 . . . . 25.0 112.553 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 m -64.16 133.05 30.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 121.703 0.763 . . . . 25.0 112.56 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -153.0 156.06 38.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 105.922 -1.881 . . . . 25.0 105.922 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.17 -169.04 23.89 Favored Glycine 0 N--CA 1.453 -0.167 0 N-CA-C 108.98 -1.648 . . . . 25.0 108.98 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -128.2 148.65 50.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.148 0.974 . . . . 25.0 111.474 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.82 157.05 31.44 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 107.473 -1.306 . . . . 25.0 107.473 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -3.47 2.19 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.751 -1.113 . . . . 25.0 112.484 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -75.89 145.5 77.88 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 108.397 -0.964 . . . . 25.0 108.397 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.75 -19.16 12.07 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 N-CA-C 116.255 1.598 . . . . 25.0 116.255 -4.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -76.61 -35.26 58.18 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.724 1.379 . . . . 25.0 114.724 -169.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.0 30.35 7.11 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.58 -176.22 43.01 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.349 -1.296 . . . . 25.0 110.978 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -62.24 171.15 5.54 Favored 'Trans proline' 0 C--O 1.241 0.626 0 C-N-CA 122.796 2.331 . . . . 25.0 113.934 178.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 159.97 30.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 106.859 -1.534 . . . . 25.0 106.859 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.77 138.17 58.13 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 107.192 -1.41 . . . . 25.0 107.192 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.39 85.67 Favored Glycine 0 C--O 1.229 -0.21 0 C-N-CA 121.468 -0.396 . . . . 25.0 112.962 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -124.92 10.9 8.29 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.742 -0.466 . . . . 25.0 109.742 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 63.3 mt -64.95 -49.15 81.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 122.217 -0.302 . . . . 25.0 111.486 -173.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.24 -21.22 56.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.073 0.463 . . . . 25.0 109.898 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.7 p -83.46 -8.65 59.33 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.569 0.581 . . . . 25.0 112.569 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.63 32.6 12.09 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.556 0.742 . . . . 25.0 110.176 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.34 38.28 25.89 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.727 1.38 . . . . 25.0 114.727 -176.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.54 137.02 54.61 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.023 0.529 . . . . 25.0 110.942 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.41 -35.78 80.3 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 115.135 1.532 . . . . 25.0 115.135 -174.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -70.95 -7.18 44.16 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.529 0.566 . . . . 25.0 112.529 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.402 ' HA ' HD11 ' A' ' 59' ' ' LEU . 12.5 m-85 -121.47 11.96 10.74 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -72.55 -35.25 67.97 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.891 -1.131 . . . . 25.0 110.218 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.9 mp0 -70.83 -16.05 62.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.889 0.852 . . . . 25.0 109.576 174.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.402 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.82 -3.8 58.91 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.789 -0.819 . . . . 25.0 108.789 -177.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -115.1 -32.13 5.81 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.293 0.479 . . . . 25.0 112.293 173.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -91.64 118.08 30.31 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 121.496 -0.752 . . . . 25.0 109.854 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.45 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.9 pm0 -124.06 161.0 26.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.921 -0.581 . . . . 25.0 110.13 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -120.0 162.71 31.97 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 100.25 -3.981 . . . . 25.0 100.25 163.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.06 -7.17 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.775 -1.683 . . . . 25.0 115.786 -175.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -125.18 10.73 8.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.225 0.536 . . . . 25.0 112.018 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -77.32 -28.47 53.19 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.723 -0.61 . . . . 25.0 112.551 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.45 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 12.3 m95 -125.11 165.85 17.47 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 120.656 0.265 . . . . 25.0 110.814 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -68.83 120.97 15.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.97 -1.863 . . . . 25.0 105.97 170.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -94.48 103.87 15.83 Favored 'General case' 0 CA--C 1.499 -1.007 1 N-CA-C 99.997 -4.075 . . . . 25.0 99.997 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -66.19 134.58 53.02 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.024 -0.989 . . . . 25.0 110.512 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.83 99.42 12.29 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.715 -1.217 . . . . 25.0 107.715 -178.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.2 mt -130.9 173.94 10.47 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.275 -1.75 . . . . 25.0 106.275 -176.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -113.4 163.73 14.5 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.786 1.032 . . . . 25.0 113.786 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 77.9 p -77.05 170.81 15.86 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.745 -1.57 . . . . 25.0 106.953 175.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.09 -161.72 29.32 Favored Glycine 0 C--O 1.241 0.581 0 N-CA-C 111.144 -0.782 . . . . 25.0 111.144 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.68 131.34 41.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 118.935 1.368 . . . . 25.0 114.132 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -138.01 160.48 39.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.342 -1.725 . . . . 25.0 106.342 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.3 p -99.39 150.35 22.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.527 -1.286 . . . . 25.0 107.527 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -137.61 100.98 4.35 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 105.54 -2.022 . . . . 25.0 105.54 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.68 112.57 25.33 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.367 -0.833 . . . . 25.0 109.988 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.3 m95 -101.7 151.65 21.78 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 25.0 110.051 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -128.61 114.33 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 104.89 -2.263 . . . . 25.0 104.89 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -116.8 117.98 31.26 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.8 0.84 . . . . 25.0 112.085 -173.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.72 -32.71 69.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.454 0.645 . . . . 25.0 109.828 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.96 106.08 17.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 25.0 110.704 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -70.09 -0.12 7.11 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 115.161 1.541 . . . . 25.0 115.161 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.34 158.32 36.55 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.607 0.241 . . . . 25.0 111.613 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.2 t -67.79 156.09 37.82 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 116.053 1.872 . . . . 25.0 116.053 -170.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.437 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.5 t -99.1 161.05 13.84 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 114.856 -1.066 . . . . 25.0 108.241 172.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 t -117.97 -15.48 9.95 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.114 0.259 . . . . 25.0 111.081 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 t -172.81 155.39 3.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.965 0.412 . . . . 25.0 111.793 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 57.6 m95 -126.67 137.44 53.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 105.137 -2.171 . . . . 25.0 105.137 166.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -139.87 146.15 38.94 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.447 -0.945 . . . . 25.0 108.447 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -137.47 133.7 34.94 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.543 -1.651 . . . . 25.0 106.543 -176.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.99 161.49 42.23 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.557 0.617 . . . . 25.0 110.562 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.4 163.13 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 114.145 1.165 . . . . 25.0 114.145 -168.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.1 p -77.71 159.85 28.83 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.216 -1.031 . . . . 25.0 108.216 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -62.74 157.66 57.29 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.909 -1.042 . . . . 25.0 109.575 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -69.59 -18.24 37.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 N-CA-C 114.861 1.062 . . . . 25.0 114.861 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -118.73 31.85 6.44 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.615 0.366 . . . . 25.0 111.985 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.504 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -76.72 163.17 27.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.723 0.773 . . . . 25.0 111.5 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -85.95 101.31 12.78 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.899 -1.046 . . . . 25.0 110.297 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.504 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.82 21.67 0.66 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 116.059 1.874 . . . . 25.0 116.059 -173.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.0 t -125.36 0.42 7.69 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.475 0.655 . . . . 25.0 109.669 173.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -103.61 158.81 31.08 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.478 -0.934 . . . . 25.0 108.478 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.62 156.01 67.69 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 121.863 0.401 . . . . 25.0 112.66 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.76 100.87 1.58 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.964 0.412 . . . . 25.0 111.817 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 57.8 p -94.14 152.66 18.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -66.21 -25.17 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.342 0.592 . . . . 25.0 110.804 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.76 -24.61 63.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.348 -0.842 . . . . 25.0 112.093 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.9 t -83.35 -5.24 59.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.709 0.29 . . . . 25.0 111.777 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -102.94 154.02 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.344 1.238 . . . . 25.0 114.344 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -95.33 96.46 9.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 103.167 -2.901 . . . . 25.0 103.167 164.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.1 mt -69.01 -6.67 29.38 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -171.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.46 123.0 83.15 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 108.57 -0.9 . . . . 25.0 108.57 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 139.54 35.07 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 115.059 -2.827 . . . . 25.0 112.148 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -92.2 -12.51 32.56 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -176.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.3 m -147.58 66.88 1.12 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.317 -0.401 . . . . 25.0 110.071 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.01 135.05 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 118.727 -1.189 . . . . 25.0 108.978 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -125.18 99.39 6.07 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.895 -2.631 . . . . 25.0 103.895 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -91.16 91.91 8.44 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 106.694 -1.595 . . . . 25.0 106.694 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -111.76 116.99 31.62 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.114 0.959 . . . . 25.0 108.568 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.73 81.58 0.43 Allowed Glycine 0 CA--C 1.501 -0.818 0 CA-C-N 115.004 -0.998 . . . . 25.0 112.312 -172.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.14 15.04 4.81 Favored Glycine 0 C--O 1.228 -0.276 0 C-N-CA 120.867 -0.682 . . . . 25.0 114.086 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.01 104.06 5.44 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.266 -1.013 . . . . 25.0 108.266 176.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.4 mt -78.74 122.06 84.29 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 107.62 -1.252 . . . . 25.0 107.62 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.0 160.84 42.32 Favored 'Trans proline' 0 C--N 1.347 0.451 0 CA-C-O 121.505 0.544 . . . . 25.0 113.478 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.98 31.95 3.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.78 -4.58 1.66 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 113.618 -1.628 . . . . 25.0 111.435 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.06 152.33 48.71 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.438 -2.43 . . . . 25.0 104.438 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.5 t -141.39 95.09 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.221 -1.77 . . . . 25.0 106.221 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.8 t -85.43 140.98 30.29 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 104.69 -2.337 . . . . 25.0 104.69 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -156.98 166.91 32.02 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.81 -1.541 . . . . 25.0 108.705 -176.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -134.11 157.57 45.82 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.17 160.49 30.2 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -105.61 115.55 30.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.068 0.23 . . . . 25.0 111.034 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.2 mt -77.38 132.62 69.24 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 108.058 -1.09 . . . . 25.0 108.058 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.69 146.5 96.69 Favored 'Trans proline' 0 C--N 1.353 0.791 0 N-CA-C 113.766 0.641 . . . . 25.0 113.766 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -82.2 -25.78 33.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.164 -0.925 . . . . 25.0 112.768 -170.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -83.83 9.83 11.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.684 0.754 . . . . 25.0 110.115 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.2 mmt-85 -116.31 58.08 0.76 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.221 -1.029 . . . . 25.0 108.221 172.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.2 p -86.0 170.85 11.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 107.551 -1.278 . . . . 25.0 107.551 175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 81.89 -163.25 43.59 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.851 1.101 . . . . 25.0 115.851 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.1 t -85.71 107.45 17.59 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.288 0.566 . . . . 25.0 110.693 -168.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -156.29 169.71 23.93 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.018 -0.537 . . . . 25.0 111.32 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -107.74 151.27 9.84 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.42 120.8 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.14 -2.17 . . . . 25.0 105.14 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -105.18 138.59 41.15 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.513 -0.767 . . . . 25.0 109.955 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -131.84 140.29 49.09 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.166 -0.679 . . . . 25.0 109.166 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -128.59 140.37 49.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.879 0.847 . . . . 25.0 112.358 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.437 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 16.6 t90 -103.42 113.12 26.37 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.395 -1.705 . . . . 25.0 106.395 173.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -94.48 119.95 33.97 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.4 mm -76.92 142.05 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 O-C-N 122.162 -0.336 . . . . 25.0 110.157 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.72 -44.34 20.96 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.551 0.691 . . . . 25.0 110.177 174.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.07 -24.63 65.08 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.778 1.399 . . . . 25.0 114.778 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.6 p -139.26 170.8 15.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 122.142 0.972 . . . . 25.0 110.648 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 18.79 1.25 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.883 -1.053 . . . . 25.0 112.386 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -89.94 148.87 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.727 -0.608 . . . . 25.0 112.172 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.29 143.0 10.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.619 -1.993 . . . . 25.0 105.619 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -146.83 133.8 20.26 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.192 0.441 . . . . 25.0 112.192 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -92.41 115.87 28.47 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.838 -0.619 . . . . 25.0 111.481 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -97.0 122.77 40.36 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.232 -1.025 . . . . 25.0 108.232 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -98.13 143.61 28.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.291 -0.413 . . . . 25.0 111.771 -177.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -125.72 136.49 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 106.144 -1.799 . . . . 25.0 106.144 167.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -97.06 130.58 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.6 -1.259 . . . . 25.0 107.6 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.74 162.66 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.904 0.705 . . . . 25.0 112.904 -174.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.79 95.07 4.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 104.964 -2.235 . . . . 25.0 104.964 168.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.1 tp -92.31 158.83 15.89 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.259 1.207 . . . . 25.0 114.259 -169.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.3 p -145.9 165.35 29.2 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.622 -0.51 . . . . 25.0 109.622 176.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.76 0 CA-C-O 118.745 -0.645 . . . . 25.0 110.29 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.3 m80 . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 121.739 0.78 . . . . 25.0 110.429 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.98 167.24 31.83 Favored Glycine 0 C--N 1.318 -0.449 1 N-CA-C 100.05 -5.22 . . . . 25.0 100.05 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -144.25 158.61 43.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 120.484 2.142 . . . . 25.0 110.732 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.52 118.94 36.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 106.428 -1.693 . . . . 25.0 106.428 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -75.91 -41.25 52.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.166 -1.379 . . . . 25.0 109.608 -174.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 t -153.97 129.01 4.93 Favored Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 105.745 -1.946 . . . . 25.0 105.745 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -64.37 131.54 12.0 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.991 0.83 . . . . 25.0 111.316 -0.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 114.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.975 -0.557 . . . . 25.0 112.396 -172.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.0 t -71.98 158.0 36.8 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -55.78 -24.31 34.94 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.264 0.626 . . . . 25.0 111.822 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.79 -54.12 36.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.82 0.819 . . . . 25.0 109.288 175.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -69.03 -34.49 75.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.398 -0.819 . . . . 25.0 110.741 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.44 -33.35 75.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.98 -0.45 . . . . 25.0 110.517 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -39.9 95.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.243 0.545 . . . . 25.0 109.873 177.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -66.32 -36.5 83.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.222 0.534 . . . . 25.0 110.061 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.4 mt -77.27 4.87 9.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.41 176.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.53 24.11 11.55 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.309 1.444 . . . . 25.0 112.647 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.442 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.7 mt -88.6 -21.38 24.05 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.841 -1.17 . . . . 25.0 107.841 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.442 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 159.21 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 106.613 -1.625 . . . . 25.0 106.613 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.2 p -132.86 175.48 9.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 122.597 0.359 . . . . 25.0 110.221 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 68.44 5.26 4.68 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.813 1.782 . . . . 25.0 115.813 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.7 m -68.16 -41.08 82.07 Favored 'General case' 0 CA--C 1.501 -0.91 0 O-C-N 121.299 -0.876 . . . . 25.0 111.017 173.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.67 -63.84 1.87 Allowed Glycine 0 C--O 1.218 -0.872 0 O-C-N 123.599 0.562 . . . . 25.0 111.93 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.5 t -87.94 -51.82 5.61 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 122.291 1.043 . . . . 25.0 112.043 -177.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.97 -13.25 16.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 114.867 -1.06 . . . . 25.0 113.141 -172.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.86 -4.1 58.41 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.735 -0.603 . . . . 25.0 111.514 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -115.01 -34.03 5.21 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.419 -0.513 . . . . 25.0 110.322 174.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -126.95 95.57 36.73 Favored Pre-proline 0 C--O 1.243 0.754 0 CA-C-O 120.664 0.269 . . . . 25.0 110.412 171.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.51 -19.44 24.84 Favored 'Trans proline' 0 C--N 1.346 0.413 0 N-CA-C 115.097 1.153 . . . . 25.0 115.097 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -91.34 14.14 15.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -176.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -62.89 -18.7 63.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.15 -0.477 . . . . 25.0 112.233 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.7 m -64.08 116.55 3.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 115.191 1.552 . . . . 25.0 115.191 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -153.09 157.44 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.15 -169.24 22.25 Favored Glycine 0 C--O 1.229 -0.168 0 N-CA-C 108.054 -2.018 . . . . 25.0 108.054 -177.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 tp -112.3 147.43 36.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.493 1.147 . . . . 25.0 112.301 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.76 156.97 31.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.676 -1.231 . . . . 25.0 107.676 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.92 -1.72 2.88 Favored Glycine 0 C--O 1.224 -0.501 0 CA-C-N 114.706 -1.134 . . . . 25.0 112.351 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -75.91 144.82 76.76 Favored Pre-proline 0 C--N 1.321 -0.649 0 O-C-N 121.664 -0.904 . . . . 25.0 110.073 -176.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -91.39 -18.07 14.67 Favored 'Cis proline' 0 CA--C 1.542 0.9 0 N-CA-C 115.585 1.34 . . . . 25.0 115.585 -6.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.46 -36.3 60.7 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.124 1.528 . . . . 25.0 115.124 -168.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.61 40.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.35 -167.58 16.69 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.219 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -59.79 168.27 5.84 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 123.1 2.533 . . . . 25.0 114.052 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.03 31.02 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.872 -1.529 . . . . 25.0 106.872 173.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -57.93 140.81 51.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.784 -1.098 . . . . 25.0 108.443 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.94 -4.05 81.68 Favored Glycine 0 C--O 1.225 -0.41 0 CA-C-N 116.012 -0.54 . . . . 25.0 113.091 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -124.25 10.33 8.66 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.456 -0.942 . . . . 25.0 108.456 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.6 mt -68.45 -51.27 48.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 122.311 -0.243 . . . . 25.0 111.25 -173.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.49 -20.23 60.73 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.886 -0.509 . . . . 25.0 109.772 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 p -84.21 -10.34 57.79 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.388 0.514 . . . . 25.0 112.388 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.42 36.15 15.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.631 0.772 . . . . 25.0 110.136 -171.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.4 t0 61.03 34.01 19.43 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.834 1.42 . . . . 25.0 114.834 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -119.26 135.2 54.81 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.952 -0.468 . . . . 25.0 111.658 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.8 p -61.05 -35.93 78.24 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -72.15 -7.27 48.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.239 0.542 . . . . 25.0 112.408 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.41 ' HA ' HD11 ' A' ' 59' ' ' LEU . 15.2 m-85 -120.39 12.26 11.63 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 107.024 -1.473 . . . . 25.0 107.024 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -72.23 -34.67 68.48 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.151 -0.968 . . . . 25.0 110.117 -175.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -70.09 -17.3 63.21 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 122.023 0.916 . . . . 25.0 110.011 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.2 -4.98 59.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.632 -0.877 . . . . 25.0 108.632 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -113.17 -32.06 6.43 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.096 0.474 . . . . 25.0 111.783 173.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -93.89 115.58 27.97 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.721 -0.612 . . . . 25.0 110.388 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.442 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -126.6 161.0 29.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.163 0.506 . . . . 25.0 109.792 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 13.3 p -118.2 161.99 32.14 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 100.45 -3.907 . . . . 25.0 100.45 162.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.02 -1.65 9.04 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 116.983 -1.545 . . . . 25.0 115.852 -174.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.7 t -127.97 12.57 6.72 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.734 0.778 . . . . 25.0 111.031 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -78.96 -30.06 44.3 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.306 -0.871 . . . . 25.0 113.121 -176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.1 m95 -124.81 165.23 18.38 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 110.309 -0.256 . . . . 25.0 110.309 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -66.44 127.62 33.0 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.454 -2.054 . . . . 25.0 105.454 170.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -101.68 107.96 19.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 100.418 -3.919 . . . . 25.0 100.418 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.19 135.37 53.38 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.915 -1.039 . . . . 25.0 110.139 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -90.41 100.89 13.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.596 -1.261 . . . . 25.0 107.596 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.1 mt -130.24 173.94 10.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.756 -1.572 . . . . 25.0 106.756 -176.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -115.26 166.46 11.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.654 0.74 . . . . 25.0 112.811 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 75.3 p -77.04 171.02 15.47 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.461 -1.681 . . . . 25.0 106.461 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.36 -162.53 33.49 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 120.585 -0.817 . . . . 25.0 111.452 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.57 131.29 39.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 118.82 1.31 . . . . 25.0 114.628 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -136.07 159.34 42.01 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.693 -1.966 . . . . 25.0 105.693 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.1 p -99.18 151.01 21.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.307 -1.368 . . . . 25.0 107.307 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -138.72 101.05 4.23 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.8 122.69 46.26 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.481 -0.933 . . . . 25.0 108.481 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -108.22 147.51 31.26 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.8 -1.091 . . . . 25.0 109.399 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -126.73 115.12 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.089 -2.559 . . . . 25.0 104.089 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -113.91 132.91 55.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.384 -0.825 . . . . 25.0 111.411 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.8 t -93.06 6.15 48.97 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.428 0.632 . . . . 25.0 109.992 173.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -118.48 138.33 52.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.026 0.441 . . . . 25.0 110.431 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -91.19 -9.19 46.3 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.635 0.606 . . . . 25.0 112.635 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -68.1 157.38 35.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.259 0.466 . . . . 25.0 112.259 -176.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.1 t -75.59 155.97 35.41 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 114.631 1.345 . . . . 25.0 114.631 -172.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.3 t -97.63 158.91 15.24 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.198 -0.91 . . . . 25.0 108.664 173.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -118.02 -15.24 9.94 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.149 0.281 . . . . 25.0 111.63 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 t -171.89 154.13 3.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.009 0.433 . . . . 25.0 111.507 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -127.13 142.01 51.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.537 -2.394 . . . . 25.0 104.537 167.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -147.12 154.57 41.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.668 -0.864 . . . . 25.0 108.668 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -137.96 136.79 37.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 106.379 -1.712 . . . . 25.0 106.379 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.98 161.87 41.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.284 0.493 . . . . 25.0 110.065 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.88 165.79 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 113.927 1.084 . . . . 25.0 113.927 -167.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -79.94 161.13 25.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 169.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.72 158.88 38.4 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.197 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.07 -19.15 39.78 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 117.4 -1.267 . . . . 25.0 114.231 -174.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -120.81 31.92 6.2 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 122.764 0.426 . . . . 25.0 111.554 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.521 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.7 p-90 -73.68 164.39 26.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.934 0.874 . . . . 25.0 112.68 -177.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.18 101.0 10.92 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.657 -1.156 . . . . 25.0 109.847 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.521 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.2 15.96 5.69 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.656 2.095 . . . . 25.0 116.656 -169.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 9.5 t -125.57 9.01 7.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.754 0.788 . . . . 25.0 109.12 176.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.7 156.18 41.92 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 114.585 -1.189 . . . . 25.0 107.943 -174.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.74 155.43 70.54 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 O-C-N 121.953 0.449 . . . . 25.0 111.673 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.41 101.09 2.83 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.587 0.708 . . . . 25.0 112.269 -175.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.9 p -89.59 155.9 18.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.255 -1.017 . . . . 25.0 108.255 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -64.34 -26.64 68.56 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.916 -0.49 . . . . 25.0 111.232 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.05 -25.13 63.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.583 -0.735 . . . . 25.0 112.464 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.8 t -79.44 -10.31 59.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.078 0.399 . . . . 25.0 112.078 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -99.4 155.87 17.31 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 114.323 1.231 . . . . 25.0 114.323 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -94.0 94.98 8.75 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 102.251 -3.24 . . . . 25.0 102.251 161.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.5 mt -66.18 -6.39 13.36 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.812 1.412 . . . . 25.0 114.812 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.5 t -85.75 127.51 62.39 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 108.602 -0.888 . . . . 25.0 108.602 176.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.44 150.3 57.79 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 115.644 -2.437 . . . . 25.0 111.459 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -101.72 -7.79 22.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.095 0.474 . . . . 25.0 111.362 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 57.3 m -148.67 68.95 1.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 25.0 109.764 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -89.08 125.37 34.99 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.705 -0.85 . . . . 25.0 108.705 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -118.92 98.92 6.43 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.058 -2.201 . . . . 25.0 105.058 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -87.96 92.05 8.99 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.019 -0.734 . . . . 25.0 109.019 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -109.67 118.83 37.59 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 106.814 -1.55 . . . . 25.0 106.814 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.54 82.51 0.34 Allowed Glycine 0 CA--C 1.5 -0.869 0 CA-C-N 115.601 -0.727 . . . . 25.0 112.862 -169.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.03 16.37 6.26 Favored Glycine 0 C--N 1.321 -0.293 0 C-N-CA 120.982 -0.628 . . . . 25.0 113.151 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.05 103.94 4.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 121.564 0.697 . . . . 25.0 109.525 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.67 125.29 91.3 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 106.164 -1.791 . . . . 25.0 106.164 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.53 167.47 26.47 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 118.197 -0.736 . . . . 25.0 113.749 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.73 26.95 4.68 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.71 -10.15 0.62 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.82 1.648 . . . . 25.0 111.656 -173.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.461 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.4 mt-30 -131.02 152.38 50.38 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 103.838 -2.652 . . . . 25.0 103.838 170.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -141.49 94.95 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 106.421 -1.696 . . . . 25.0 106.421 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -88.14 140.94 28.98 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 104.749 -2.315 . . . . 25.0 104.749 173.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.7 166.92 27.92 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.101 -1.814 . . . . 25.0 106.101 -177.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -134.49 152.96 52.13 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.722 -2.325 . . . . 25.0 104.722 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 158.86 34.76 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.515 -1.291 . . . . 25.0 107.515 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -105.29 116.58 32.19 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.247 0.342 . . . . 25.0 111.408 -174.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 57.7 mt -77.68 131.94 69.69 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -61.64 147.1 96.16 Favored 'Trans proline' 0 C--N 1.353 0.763 0 N-CA-C 113.762 0.639 . . . . 25.0 113.762 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.74 -27.26 40.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.079 -0.964 . . . . 25.0 112.696 -169.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -83.99 9.77 11.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.62 -0.718 . . . . 25.0 110.185 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -116.2 50.42 1.04 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 172.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 42.3 p -86.07 160.49 19.28 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 175.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 94.4 -168.49 28.24 Favored Glycine 0 C--O 1.237 0.326 0 N-CA-C 114.285 0.474 . . . . 25.0 114.285 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.5 t -86.14 114.89 23.35 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.352 0.596 . . . . 25.0 111.181 -169.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.9 p-80 -160.0 171.7 18.87 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.75 -0.659 . . . . 25.0 110.257 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -107.15 151.6 8.99 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 107.757 -1.201 . . . . 25.0 107.757 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.1 mt -132.93 121.9 45.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.57 129.87 52.6 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.635 -0.712 . . . . 25.0 109.748 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -114.6 130.82 56.82 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 108.973 -0.751 . . . . 25.0 108.973 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 1.7 p -125.46 137.55 57.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 122.043 0.925 . . . . 25.0 112.637 -177.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -111.92 118.46 35.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.77 -1.559 . . . . 25.0 106.954 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -98.63 125.31 43.87 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.539 -0.911 . . . . 25.0 108.539 178.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 21.7 mm -80.55 141.59 15.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.309 -0.626 . . . . 25.0 109.309 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.35 21.65 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.723 0.692 . . . . 25.0 110.476 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.01 -23.72 65.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.993 1.108 . . . . 25.0 113.993 -171.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.2 p -138.95 168.62 19.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.958 0.885 . . . . 25.0 110.248 -174.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.76 28.74 0.33 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.348 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -99.11 145.78 26.8 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.964 0.727 . . . . 25.0 112.964 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.3 146.13 15.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.279 -2.119 . . . . 25.0 105.279 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -148.16 138.11 22.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 111.87 0.322 . . . . 25.0 111.87 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.03 113.22 25.02 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 123.735 0.647 . . . . 25.0 111.205 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -97.06 111.9 23.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.981 -0.748 . . . . 25.0 108.981 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.42 141.13 30.19 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.467 0.543 . . . . 25.0 112.467 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -125.94 135.45 63.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 105.637 -1.986 . . . . 25.0 105.637 166.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -94.43 131.63 39.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.17 -1.419 . . . . 25.0 107.17 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.8 m -132.17 162.01 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.807 0.669 . . . . 25.0 112.807 -175.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -119.74 95.0 4.59 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.392 -2.447 . . . . 25.0 104.392 169.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.17 162.75 14.53 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 112.903 0.705 . . . . 25.0 112.903 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.4 p -145.92 161.1 40.81 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.425 -0.954 . . . . 25.0 108.425 174.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.888 -0.577 . . . . 25.0 110.558 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.476 0.655 . . . . 25.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.17 168.99 37.14 Favored Glycine 0 CA--C 1.509 -0.293 1 N-CA-C 101.691 -4.564 . . . . 25.0 101.691 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 p90 -146.83 165.06 30.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.318 2.059 . . . . 25.0 110.583 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.65 123.33 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.199 -1.037 . . . . 25.0 108.199 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.09 -43.08 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.63 -1.168 . . . . 25.0 109.883 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 t -154.24 129.2 4.94 Favored Pre-proline 0 C--N 1.321 -0.666 0 N-CA-C 106.35 -1.722 . . . . 25.0 106.35 177.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -65.17 131.25 12.46 Favored 'Cis proline' 0 CA--C 1.532 0.418 0 C-N-CA 128.903 0.793 . . . . 25.0 110.92 -0.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.93 112.4 4.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.023 -0.535 . . . . 25.0 112.129 -172.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.9 t -72.23 157.84 36.98 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 107.566 -1.272 . . . . 25.0 107.566 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -55.48 -25.06 34.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.138 0.575 . . . . 25.0 112.238 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.61 -53.48 46.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.807 0.813 . . . . 25.0 109.447 175.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -70.39 -32.46 70.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.63 -0.714 . . . . 25.0 110.925 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -63.51 -32.4 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.847 -0.533 . . . . 25.0 110.374 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -40.3 96.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.38 0.609 . . . . 25.0 109.47 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -66.18 -36.15 82.32 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.887 -0.597 . . . . 25.0 110.206 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -78.24 5.3 10.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 25.0 111.518 177.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 58.35 24.45 11.66 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.158 1.383 . . . . 25.0 112.69 -179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.449 ' C ' HD21 ' A' ' 19' ' ' ASN . 94.6 mt -89.74 -21.65 22.57 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.933 -1.136 . . . . 25.0 107.933 174.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.449 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.93 159.12 28.94 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 106.581 -1.637 . . . . 25.0 106.581 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.2 p -133.04 176.51 8.43 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -175.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 71.94 0.09 3.41 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.624 1.713 . . . . 25.0 115.624 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.1 m -65.95 -43.33 88.29 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 121.633 -0.667 . . . . 25.0 111.745 175.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.73 -63.24 1.94 Allowed Glycine 0 C--O 1.218 -0.891 0 O-C-N 123.598 0.561 . . . . 25.0 111.939 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -87.67 -51.46 5.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.989 0.899 . . . . 25.0 111.857 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.3 t -66.66 -13.2 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.177 -0.92 . . . . 25.0 113.235 -172.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.87 -4.99 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.436 -0.79 . . . . 25.0 111.857 178.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -112.56 -34.07 5.95 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 25.0 109.515 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.3 100.45 29.46 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.399 -0.593 . . . . 25.0 109.399 172.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.1 -19.87 22.34 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.758 -1.028 . . . . 25.0 113.793 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -88.82 15.78 7.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.187 0.439 . . . . 25.0 112.187 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 71.2 m -63.22 -23.13 67.29 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.978 0.418 . . . . 25.0 111.585 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 m -64.04 122.0 14.1 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 115.371 1.619 . . . . 25.0 115.371 -175.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -152.88 159.04 42.98 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 174.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.03 -165.48 17.02 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 108.333 -1.907 . . . . 25.0 108.333 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.04 148.09 45.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.437 1.118 . . . . 25.0 112.546 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -67.27 156.87 35.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.336 -1.357 . . . . 25.0 107.336 171.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.32 -3.49 1.91 Allowed Glycine 0 C--O 1.224 -0.522 0 CA-C-N 114.816 -1.084 . . . . 25.0 112.309 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -75.93 144.06 75.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 O-C-N 121.826 -0.809 . . . . 25.0 108.861 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -91.48 -17.32 15.96 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 N-CA-C 115.581 1.339 . . . . 25.0 115.581 -5.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -70.67 -35.34 72.79 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.73 1.381 . . . . 25.0 114.73 -169.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -119.01 35.14 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.547 -2.02 . . . . 25.0 105.547 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.12 177.21 47.57 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.617 -1.174 . . . . 25.0 111.691 -177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.94 172.2 4.15 Favored 'Trans proline' 0 C--O 1.241 0.635 0 C-N-CA 123.924 3.082 . . . . 25.0 113.821 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.96 159.86 31.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.789 -1.56 . . . . 25.0 106.789 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.17 138.68 57.86 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.258 -1.337 . . . . 25.0 107.438 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.08 -4.7 82.48 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.258 -0.496 . . . . 25.0 113.063 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.2 m170 -124.27 9.27 8.55 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.253 -0.647 . . . . 25.0 109.253 178.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.3 mt -64.87 -49.49 79.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.703 -0.226 . . . . 25.0 111.259 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.58 -29.3 63.4 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 p -77.54 -8.29 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.596 0.962 . . . . 25.0 113.596 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.52 34.26 18.02 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.641 0.776 . . . . 25.0 109.816 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.29 38.51 26.02 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.956 1.465 . . . . 25.0 114.956 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -119.67 134.73 55.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.106 0.562 . . . . 25.0 111.108 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 p -62.29 -34.7 77.09 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.915 1.82 . . . . 25.0 115.915 -173.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.42 -7.66 44.86 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.251 0.548 . . . . 25.0 112.437 -177.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.8 m-85 -122.51 14.23 10.25 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 107.521 -1.289 . . . . 25.0 107.521 -178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.49 -38.17 71.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.227 -0.921 . . . . 25.0 110.405 -176.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -71.5 -17.34 62.35 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 122.032 0.92 . . . . 25.0 109.345 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.2 mp -83.61 -5.94 59.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.553 -0.906 . . . . 25.0 108.553 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -111.82 -32.06 6.74 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -96.58 116.45 29.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 121.471 -0.768 . . . . 25.0 111.127 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.454 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -122.64 160.55 25.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.881 -0.6 . . . . 25.0 109.466 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 6.1 p -116.93 162.57 26.78 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 100.541 -3.874 . . . . 25.0 100.541 162.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.55 -5.38 15.1 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 116.852 -1.632 . . . . 25.0 115.763 -175.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 t -125.67 12.38 7.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.291 0.567 . . . . 25.0 111.419 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -77.67 -29.44 51.55 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.817 0.673 . . . . 25.0 112.817 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.454 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.0 m95 -126.8 168.07 14.93 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 120.674 0.273 . . . . 25.0 110.505 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.0 t-20 -66.77 131.02 45.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 105.436 -2.061 . . . . 25.0 105.436 168.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -104.94 108.09 19.41 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 100.587 -3.857 . . . . 25.0 100.587 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.0 135.83 54.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 114.891 -1.05 . . . . 25.0 110.178 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -92.56 100.22 12.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.626 -1.17 . . . . 25.0 107.91 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.78 173.88 10.71 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.132 -1.803 . . . . 25.0 106.132 -176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -116.09 166.18 12.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.629 0.974 . . . . 25.0 113.629 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.3 p -77.04 169.14 18.87 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.96 -162.25 28.6 Favored Glycine 0 C--O 1.241 0.544 0 N-CA-C 111.078 -0.809 . . . . 25.0 111.078 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.08 133.32 52.46 Favored 'Trans proline' 0 C--N 1.346 0.422 0 CA-C-N 118.889 1.345 . . . . 25.0 114.212 -177.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -138.38 161.62 36.5 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.438 -1.69 . . . . 25.0 106.438 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -104.63 152.29 22.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.216 -1.401 . . . . 25.0 107.216 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -140.77 100.95 3.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.06 -1.83 . . . . 25.0 106.06 -176.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.46 113.8 27.58 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.83 0.824 . . . . 25.0 109.657 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.9 m95 -105.34 152.96 22.28 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.432 -0.804 . . . . 25.0 110.765 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -128.14 114.16 16.65 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.2 mp -115.85 104.92 12.11 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.297 -0.865 . . . . 25.0 112.812 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.9 t -70.91 -22.82 62.2 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.832 -0.803 . . . . 25.0 108.832 171.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.1 98.96 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 175.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -70.04 -18.9 63.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.297 1.221 . . . . 25.0 114.297 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -78.84 167.11 21.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.671 0.619 . . . . 25.0 112.671 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.6 t -64.54 155.54 32.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 117.254 2.316 . . . . 25.0 117.254 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 t -103.52 158.83 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 172.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.97 -12.76 10.07 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.398 0.518 . . . . 25.0 112.398 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.2 t -171.4 151.93 3.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.019 0.438 . . . . 25.0 112.171 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.5 m95 -127.23 139.76 52.69 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.105 -2.554 . . . . 25.0 104.105 167.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -145.82 144.59 30.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.37 -1.344 . . . . 25.0 107.37 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -133.86 134.47 42.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -149.29 163.13 38.56 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.556 -0.535 . . . . 25.0 109.556 178.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.85 165.12 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 113.685 0.994 . . . . 25.0 113.685 -168.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 16.6 p -79.11 161.69 26.33 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 169.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -61.14 159.04 31.54 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 25.0 109.205 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.72 -25.24 34.01 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 116.096 -2.136 . . . . 25.0 113.314 -175.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -114.43 32.06 6.2 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.034 0.534 . . . . 25.0 110.632 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.9 p-90 -73.24 167.41 21.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 122.029 0.918 . . . . 25.0 113.032 -176.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -83.16 101.08 10.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.447 -1.251 . . . . 25.0 109.59 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -93.48 8.56 40.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 14.1 t -118.03 9.76 12.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.401 -0.963 . . . . 25.0 108.401 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -115.11 157.76 42.72 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.115 -1.402 . . . . 25.0 107.599 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -65.67 157.46 58.55 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 O-C-N 121.982 0.464 . . . . 25.0 111.226 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.93 100.95 2.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.227 0.537 . . . . 25.0 111.722 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.1 p -89.31 156.99 18.37 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.305 -1.368 . . . . 25.0 107.305 174.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.66 -24.93 66.35 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.44 0.638 . . . . 25.0 110.762 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.7 -25.96 64.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.996 -1.002 . . . . 25.0 112.914 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 m -80.6 -8.34 59.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 25.0 112.396 -177.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 41.9 m-85 -98.13 154.28 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 115.158 1.54 . . . . 25.0 115.158 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -97.02 96.44 8.48 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 102.614 -3.106 . . . . 25.0 102.614 162.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.92 -7.28 20.94 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -169.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -80.65 132.28 58.56 Favored Pre-proline 0 C--N 1.323 -0.58 0 N-CA-C 109.122 -0.696 . . . . 25.0 109.122 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -73.74 152.3 47.33 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 115.069 -2.821 . . . . 25.0 111.082 177.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -107.46 -11.41 15.51 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.988 0.423 . . . . 25.0 111.49 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.3 m -149.32 67.91 1.03 Allowed 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.317 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.58 138.99 30.99 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.126 -1.03 . . . . 25.0 108.738 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.79 101.04 5.71 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 104.715 -2.328 . . . . 25.0 104.715 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -94.56 92.19 6.95 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.5 -0.926 . . . . 25.0 108.5 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -108.55 122.08 46.31 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 107.067 -1.457 . . . . 25.0 107.067 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.39 37.74 3.4 Favored Glycine 0 C--O 1.224 -0.489 0 N-CA-C 117.129 1.612 . . . . 25.0 117.129 -168.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 162.38 23.92 0.02 OUTLIER Glycine 0 C--N 1.319 -0.389 0 C-N-CA 120.354 -0.927 . . . . 25.0 113.452 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.62 104.16 9.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.381 0.61 . . . . 25.0 110.323 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 91.4 mt -75.47 123.57 88.62 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 104.894 -2.262 . . . . 25.0 104.894 173.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.75 165.34 33.01 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 117.725 -1.05 . . . . 25.0 113.577 -175.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.451 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.8 26.33 3.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 175.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.64 -8.43 0.92 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.987 1.715 . . . . 25.0 111.228 -173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.9 mt-30 -135.04 153.65 51.98 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.064 -2.569 . . . . 25.0 104.064 171.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.72 95.28 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.71 141.94 29.37 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 104.058 -2.571 . . . . 25.0 104.058 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.32 167.03 31.33 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.549 -1.659 . . . . 25.0 109.323 -176.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -134.54 157.38 46.69 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.655 -1.609 . . . . 25.0 106.655 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.46 160.89 26.8 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -108.22 114.98 29.28 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.333 0.396 . . . . 25.0 111.316 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.3 mt -78.58 132.76 64.36 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.68 -0.859 . . . . 25.0 108.68 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -62.35 147.44 94.94 Favored 'Trans proline' 0 C--N 1.354 0.841 0 CA-C-N 118.741 0.586 . . . . 25.0 113.611 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.55 -26.25 35.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 25.0 112.895 -169.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 p-10 -84.0 9.02 13.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 25.0 110.055 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -116.54 53.43 0.88 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 172.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.5 p -86.91 168.35 13.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 106.525 -1.657 . . . . 25.0 106.525 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 89.67 -167.55 33.76 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 115.535 0.974 . . . . 25.0 115.535 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.2 t -85.84 107.99 17.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.315 0.579 . . . . 25.0 110.707 -169.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -157.12 171.45 20.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.875 -0.602 . . . . 25.0 110.866 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.24 151.25 9.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 N-CA-C 107.816 -1.179 . . . . 25.0 107.816 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.8 mt -131.88 120.64 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 104.758 -2.312 . . . . 25.0 104.758 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.95 130.38 50.0 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.744 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.27 122.27 42.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.487 -0.931 . . . . 25.0 108.487 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.33 140.24 36.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 122.077 0.942 . . . . 25.0 110.197 -178.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -124.25 122.21 37.15 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.25 129.43 50.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 123.238 0.615 . . . . 25.0 109.963 -175.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 43.7 mm -78.06 140.93 16.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.681 -0.489 . . . . 25.0 109.681 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.41 -44.27 25.29 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.773 0.715 . . . . 25.0 111.027 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.26 -23.03 64.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 114.659 1.355 . . . . 25.0 114.659 -172.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.6 p -139.29 170.88 15.13 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.921 0.867 . . . . 25.0 109.707 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.82 23.06 0.56 Allowed 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.365 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -94.2 143.75 26.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.593 -0.692 . . . . 25.0 112.822 -176.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.28 145.58 16.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 104.647 -2.353 . . . . 25.0 104.647 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -147.52 140.01 24.63 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.083 0.771 . . . . 25.0 113.083 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -94.63 112.3 24.05 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.63 0.772 . . . . 25.0 111.496 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -97.06 108.21 20.9 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.38 141.08 29.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.311 -0.859 . . . . 25.0 111.83 -176.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.4 tt -125.58 134.59 66.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.187 -1.783 . . . . 25.0 106.187 167.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.34 130.67 39.02 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.317 -1.364 . . . . 25.0 107.317 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.3 m -131.54 161.19 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 112.81 0.67 . . . . 25.0 112.81 -175.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -118.67 95.1 4.71 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 104.059 -2.571 . . . . 25.0 104.059 168.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -93.14 160.42 14.85 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 113.172 0.804 . . . . 25.0 113.172 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 65.6 p -145.97 167.17 23.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.77 -0.826 . . . . 25.0 108.77 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.869 -0.586 . . . . 25.0 109.94 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.8 m80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.248 -0.278 . . . . 25.0 110.248 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.01 170.59 12.9 Favored Glycine 0 C--N 1.322 -0.201 0 N-CA-C 103.507 -3.837 . . . . 25.0 103.507 -172.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -148.85 169.92 19.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 119.594 1.697 . . . . 25.0 111.385 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 126.11 62.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.031 -1.47 . . . . 25.0 107.031 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.64 -43.01 49.91 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.388 -0.824 . . . . 25.0 109.408 -175.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -153.56 133.57 7.62 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 105.503 -2.036 . . . . 25.0 105.503 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -65.25 135.46 23.53 Favored 'Cis proline' 0 CA--C 1.533 0.469 0 C-N-CA 128.754 0.731 . . . . 25.0 111.999 0.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.17 107.36 1.92 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.773 -0.649 . . . . 25.0 112.431 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 t -71.85 156.69 39.01 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.634 -0.506 . . . . 25.0 109.634 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 -55.4 -25.93 38.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.815 0.846 . . . . 25.0 112.444 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.25 -53.36 45.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.798 0.809 . . . . 25.0 109.134 175.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -66.37 -33.92 76.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.506 -0.77 . . . . 25.0 110.84 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.17 -33.2 75.24 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.948 -0.47 . . . . 25.0 110.244 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -37.52 84.83 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 178.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -62.66 -39.22 93.24 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.257 0.551 . . . . 25.0 109.857 175.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.2 mt -77.45 5.12 9.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.025 -0.534 . . . . 25.0 112.117 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 58.62 22.13 9.48 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.115 1.366 . . . . 25.0 112.814 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.462 ' C ' HD21 ' A' ' 19' ' ' ASN . 95.1 mt -85.2 -20.16 30.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.895 -1.15 . . . . 25.0 107.895 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.462 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -121.81 156.72 32.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.314 -1.735 . . . . 25.0 106.314 177.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 p -134.58 175.98 9.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.366 -0.605 . . . . 25.0 109.366 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 68.08 5.01 4.36 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 175.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.2 m -67.25 -33.15 74.73 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 121.451 -0.781 . . . . 25.0 111.777 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.66 -62.61 1.55 Allowed Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.733 0.645 . . . . 25.0 112.376 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 t -91.75 -50.81 5.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 114.945 1.461 . . . . 25.0 114.945 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.98 -14.28 13.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.122 -1.399 . . . . 25.0 114.12 -165.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -79.45 -7.6 58.53 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.574 -0.85 . . . . 25.0 112.382 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -104.14 -38.92 6.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.229 -0.988 . . . . 25.0 111.048 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -131.21 95.98 23.2 Favored Pre-proline 0 C--O 1.241 0.641 0 N-CA-C 111.785 0.291 . . . . 25.0 111.785 168.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.26 -19.06 29.73 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 116.91 -1.593 . . . . 25.0 115.383 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -81.42 5.57 17.2 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 121.575 -0.703 . . . . 25.0 112.178 -178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.4 m -66.45 -12.35 56.78 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.77 0.656 . . . . 25.0 112.77 177.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.05 132.88 29.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.881 0.848 . . . . 25.0 112.782 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -152.98 150.42 29.21 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.64 -168.38 17.92 Favored Glycine 0 CA--C 1.51 -0.261 0 N-CA-C 109.504 -1.439 . . . . 25.0 109.504 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -127.92 146.64 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.764 0.782 . . . . 25.0 111.174 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.98 157.01 29.42 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.176 -1.046 . . . . 25.0 108.176 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.27 -4.0 1.99 Allowed Glycine 0 C--N 1.318 -0.451 0 CA-C-N 114.726 -1.124 . . . . 25.0 112.847 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -75.96 148.09 81.29 Favored Pre-proline 0 C--N 1.321 -0.632 0 O-C-N 121.623 -0.928 . . . . 25.0 109.075 -177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -90.8 -18.64 14.53 Favored 'Cis proline' 0 CA--C 1.541 0.875 0 N-CA-C 115.95 1.481 . . . . 25.0 115.95 -4.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -77.77 -35.8 51.28 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.924 1.453 . . . . 25.0 114.924 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.02 33.27 5.33 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.364 -1.717 . . . . 25.0 106.364 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.07 -174.86 45.26 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.626 -1.17 . . . . 25.0 111.415 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -60.44 171.5 3.3 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 123.793 2.995 . . . . 25.0 113.322 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.14 159.98 30.99 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.23 137.38 58.0 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 106.652 -1.61 . . . . 25.0 106.652 176.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.21 -6.04 82.7 Favored Glycine 0 CA--C 1.509 -0.298 0 CA-C-O 121.416 0.453 . . . . 25.0 113.413 -174.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 51.0 m170 -125.02 10.04 8.15 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.404 -0.468 . . . . 25.0 110.218 179.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.8 mt -64.23 -48.77 84.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.443 -0.16 . . . . 25.0 111.232 -173.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.81 -24.34 55.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.072 0.463 . . . . 25.0 110.004 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.3 p -81.62 -8.61 59.73 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.031 0.752 . . . . 25.0 113.031 -176.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.89 34.79 17.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.714 0.805 . . . . 25.0 110.075 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.44 41.11 23.33 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -177.818 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -121.34 135.01 55.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.287 0.635 . . . . 25.0 110.781 174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.56 -34.44 77.81 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 115.497 1.665 . . . . 25.0 115.497 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 t -71.42 -8.05 51.32 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.347 0.594 . . . . 25.0 112.346 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.41 ' HA ' HD11 ' A' ' 59' ' ' LEU . 13.3 m-85 -119.1 15.02 13.22 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.447 -1.316 . . . . 25.0 107.447 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.81 -37.89 70.31 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.1 -1.0 . . . . 25.0 110.401 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.4 mp0 -70.2 -16.31 63.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.879 0.847 . . . . 25.0 110.042 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 56' ' ' PHE . 2.4 mp -86.16 -5.72 59.14 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -112.49 -32.31 6.52 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.104 0.409 . . . . 25.0 112.104 173.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -96.07 121.89 38.32 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 121.628 -0.67 . . . . 25.0 110.185 -178.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.454 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -128.03 160.87 30.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.504 -0.771 . . . . 25.0 109.731 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.3 p -114.39 161.19 29.75 Favored Pre-proline 0 C--N 1.319 -0.74 1 N-CA-C 100.11 -4.033 . . . . 25.0 100.11 161.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 -2.16 9.67 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 116.961 -1.56 . . . . 25.0 115.765 -174.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -127.34 11.73 6.94 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.231 0.539 . . . . 25.0 111.65 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -78.93 -31.05 45.05 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.028 0.751 . . . . 25.0 113.028 -176.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.454 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.9 m95 -122.58 167.17 13.73 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 110.047 -0.353 . . . . 25.0 110.047 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -68.19 125.0 24.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.009 -1.848 . . . . 25.0 106.009 172.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -100.44 106.11 17.65 Favored 'General case' 0 CA--C 1.5 -0.981 0 N-CA-C 100.511 -3.885 . . . . 25.0 100.511 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.32 135.75 52.36 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.97 -1.014 . . . . 25.0 110.81 -176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -88.89 100.84 13.49 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 107.912 -1.144 . . . . 25.0 107.912 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.77 174.05 10.33 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.883 -1.895 . . . . 25.0 105.883 -177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -115.42 166.51 11.8 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.687 0.995 . . . . 25.0 113.687 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.5 p -77.12 171.61 14.55 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 106.297 -1.742 . . . . 25.0 106.297 173.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.99 -161.35 33.05 Favored Glycine 0 C--O 1.24 0.517 0 C-N-CA 120.436 -0.888 . . . . 25.0 111.198 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.09 132.95 50.06 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 119.013 1.406 . . . . 25.0 114.392 -176.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -139.41 158.74 43.62 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.7 p -100.2 150.18 22.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -139.11 100.93 4.15 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 105.527 -2.027 . . . . 25.0 105.527 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.54 111.07 23.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.008 0.909 . . . . 25.0 111.004 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -97.8 147.42 24.41 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.305 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -124.01 110.55 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.602 -2.37 . . . . 25.0 104.602 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.44 130.91 45.74 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.166 -0.925 . . . . 25.0 109.478 -171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.7 t -72.73 -10.92 60.36 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.672 0.619 . . . . 25.0 112.672 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.98 147.6 27.35 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.805 -0.813 . . . . 25.0 108.805 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 mtm180 -81.22 13.68 2.74 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.287 0.847 . . . . 25.0 113.287 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.98 152.36 32.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.956 -0.757 . . . . 25.0 108.956 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.1 t -69.47 155.95 39.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.723 1.009 . . . . 25.0 113.723 -170.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.468 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 3.1 t -102.19 156.55 17.49 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.276 -1.379 . . . . 25.0 107.276 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.84 -15.94 10.0 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.168 0.293 . . . . 25.0 110.771 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 t -172.54 152.08 2.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.891 0.377 . . . . 25.0 111.975 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.67 140.71 52.72 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 103.687 -2.709 . . . . 25.0 103.687 166.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -145.82 150.97 37.15 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.089 0.859 . . . . 25.0 108.978 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -137.98 137.49 37.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.084 -1.821 . . . . 25.0 106.084 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -147.88 160.09 43.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.24 164.5 34.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.217 0.821 . . . . 25.0 113.217 -168.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 p -79.76 162.51 25.1 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.434 -0.95 . . . . 25.0 108.434 171.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -64.06 161.87 35.81 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.249 -0.887 . . . . 25.0 109.472 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.59 -18.73 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 116.505 -1.863 . . . . 25.0 113.812 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.83 32.01 6.16 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.129 0.571 . . . . 25.0 111.034 -177.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.503 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 10.4 p-90 -68.94 172.68 6.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.293 1.22 . . . . 25.0 114.293 -176.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -83.11 98.41 9.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.0 -1.0 . . . . 25.0 109.099 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.503 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -96.27 5.3 51.28 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.913 1.82 . . . . 25.0 115.913 -168.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -128.42 17.22 6.5 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -122.53 161.0 45.99 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 114.195 -1.366 . . . . 25.0 107.503 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.96 151.92 82.05 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 118.443 -0.571 . . . . 25.0 111.133 173.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 108.81 3.44 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.554 0.575 . . . . 25.0 112.554 -175.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.7 p -95.66 153.31 17.79 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.126 -1.065 . . . . 25.0 108.126 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -68.13 -22.59 64.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.422 0.63 . . . . 25.0 110.111 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.81 -29.65 68.87 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.943 -1.026 . . . . 25.0 112.28 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.76 -3.04 59.0 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.045 0.387 . . . . 25.0 112.045 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -100.01 152.27 20.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 114.021 1.119 . . . . 25.0 114.021 -177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -97.02 92.85 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.632 -2.729 . . . . 25.0 103.632 165.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.0 mt -66.66 -6.49 15.72 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.564 1.32 . . . . 25.0 114.564 -170.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.43 122.02 78.69 Favored Pre-proline 0 C--N 1.323 -0.543 0 N-CA-C 108.856 -0.794 . . . . 25.0 108.856 176.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.85 135.6 28.22 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 115.26 -2.693 . . . . 25.0 111.945 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -87.0 -13.62 43.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 -175.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.2 m -146.55 63.32 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.508 -0.314 . . . . 25.0 111.828 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -89.07 134.92 33.82 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 118.152 -1.419 . . . . 25.0 108.874 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -122.58 98.99 6.17 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 104.239 -2.504 . . . . 25.0 104.239 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -90.32 92.05 8.75 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.045 -1.095 . . . . 25.0 108.045 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -106.31 122.06 45.49 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.75 84.11 0.39 Allowed Glycine 0 CA--C 1.504 -0.602 0 CA-C-N 115.123 -0.944 . . . . 25.0 112.811 -171.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.56 15.63 13.31 Favored Glycine 0 C--N 1.32 -0.337 0 C-N-CA 120.901 -0.666 . . . . 25.0 113.464 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.13 106.73 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.366 -0.976 . . . . 25.0 108.366 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 79.2 mt -72.48 117.58 60.2 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 107.583 -1.266 . . . . 25.0 107.583 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -76.94 166.89 26.11 Favored 'Trans proline' 0 C--N 1.345 0.35 0 N-CA-C 114.682 0.993 . . . . 25.0 114.682 -176.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.427 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.44 26.39 4.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.763 -0.829 . . . . 25.0 108.763 178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.72 -16.89 0.37 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.688 1.595 . . . . 25.0 112.33 -175.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.3 mt-30 -129.31 146.96 51.11 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 103.988 -2.597 . . . . 25.0 103.988 172.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.8 t -138.71 95.03 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -89.26 132.66 34.79 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 104.662 -2.348 . . . . 25.0 104.662 173.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -145.2 166.98 23.88 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -175.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -132.11 156.39 46.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.85 159.87 33.03 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -104.67 119.03 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.08 0.238 . . . . 25.0 111.191 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.27 132.81 61.7 Favored Pre-proline 0 C--O 1.24 0.6 0 N-CA-C 108.276 -1.009 . . . . 25.0 108.276 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -60.64 147.41 94.83 Favored 'Trans proline' 0 C--N 1.354 0.844 0 N-CA-C 113.84 0.669 . . . . 25.0 113.84 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.41 -26.46 35.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.159 -0.928 . . . . 25.0 112.717 -169.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -83.63 10.35 9.4 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.744 0.783 . . . . 25.0 110.208 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -115.97 51.4 0.96 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.43 -0.952 . . . . 25.0 108.43 172.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.4 p -86.24 162.22 18.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.582 -1.636 . . . . 25.0 106.582 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.6 -165.68 29.9 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 114.839 0.696 . . . . 25.0 114.839 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 37.4 t -85.85 110.85 19.68 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.491 0.662 . . . . 25.0 110.954 -168.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -157.39 170.98 21.22 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 115.72 -0.673 . . . . 25.0 110.493 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.63 151.54 11.88 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 107.725 -1.213 . . . . 25.0 107.725 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 58.8 mt -131.55 121.27 47.7 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 104.809 -2.293 . . . . 25.0 104.809 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -103.05 128.76 49.8 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.663 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.43 131.59 56.27 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 123.005 0.522 . . . . 25.0 109.804 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.42 145.76 34.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 122.125 0.965 . . . . 25.0 112.249 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.468 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 12.7 t90 -116.77 119.37 35.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 173.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.81 121.41 38.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 7.4 mm -77.28 143.51 12.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.156 -1.053 . . . . 25.0 108.156 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.54 -41.02 28.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.847 0.749 . . . . 25.0 109.637 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.16 -22.69 64.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.011 1.115 . . . . 25.0 114.011 -172.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -138.5 169.14 18.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.993 0.902 . . . . 25.0 110.236 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 17.96 1.45 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.162 -0.926 . . . . 25.0 111.969 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -90.03 144.65 25.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.915 0.709 . . . . 25.0 112.915 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.49 141.34 14.62 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.089 -2.189 . . . . 25.0 105.089 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -146.51 131.85 18.55 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 117.766 0.257 . . . . 25.0 111.432 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -89.95 117.32 28.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.955 -0.566 . . . . 25.0 110.916 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -96.96 107.99 20.62 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.1 140.79 32.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.641 -0.709 . . . . 25.0 111.999 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 134.4 66.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.404 -1.702 . . . . 25.0 106.404 168.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -92.47 132.21 36.98 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.886 -1.153 . . . . 25.0 107.886 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -133.54 161.74 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -176.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -120.64 95.0 4.54 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.637 -2.357 . . . . 25.0 104.637 169.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.58 160.1 16.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 113.277 0.843 . . . . 25.0 113.277 -170.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.4 p -145.8 166.58 25.51 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.821 -0.437 . . . . 25.0 109.821 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.709 -0.662 . . . . 25.0 110.333 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 47.0 m170 . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.963 0.411 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.66 30.97 Favored Glycine 0 N--CA 1.45 -0.377 1 N-CA-C 102.709 -4.156 . . . . 25.0 102.709 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -147.32 168.52 21.57 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 119.523 1.662 . . . . 25.0 109.276 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -105.28 122.83 59.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 108.147 -1.057 . . . . 25.0 108.147 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -72.22 -42.69 65.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.845 -1.071 . . . . 25.0 109.697 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 t -153.02 129.24 5.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -64.67 134.46 19.29 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 128.798 0.749 . . . . 25.0 111.585 -0.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 113.17 4.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.626 0.602 . . . . 25.0 112.626 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.448 ' HG ' ' HB3' ' A' ' 162' ' ' GLN . 14.2 t -72.11 155.03 40.73 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.104 -0.702 . . . . 25.0 109.104 -178.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -56.74 -26.38 57.03 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.286 0.635 . . . . 25.0 112.163 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -48.41 63.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -66.38 -36.65 83.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.624 -0.716 . . . . 25.0 109.638 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.84 -33.43 75.66 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 122.228 -0.295 . . . . 25.0 110.587 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -39.64 93.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 25.0 109.96 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -66.63 -35.37 80.01 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.211 0.529 . . . . 25.0 110.071 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.4 mt -79.4 6.42 10.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.485 . . . . 25.0 111.731 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 59.09 21.45 9.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.056 1.343 . . . . 25.0 113.314 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.456 ' C ' HD21 ' A' ' 19' ' ' ASN . 92.5 mt -87.75 -20.62 25.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.996 -1.113 . . . . 25.0 107.996 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.456 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.0 m120 -123.33 158.95 29.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.075 -2.194 . . . . 25.0 105.075 176.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.1 p -135.38 174.68 10.34 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 122.307 0.243 . . . . 25.0 110.447 -175.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 69.71 5.08 5.03 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.978 1.844 . . . . 25.0 115.978 174.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.1 m -66.8 -39.25 87.69 Favored 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 121.483 -0.761 . . . . 25.0 110.491 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.87 -64.19 1.55 Allowed Glycine 0 C--O 1.217 -0.965 0 O-C-N 123.593 0.558 . . . . 25.0 112.303 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 t -88.01 -53.69 4.6 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.655 1.217 . . . . 25.0 111.592 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.95 -6.9 7.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.32 -1.309 . . . . 25.0 113.377 -171.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.34 2.59 52.21 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.08 -0.387 . . . . 25.0 111.508 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -116.78 -37.93 3.54 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.4 -0.92 . . . . 25.0 111.383 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -127.51 93.68 39.99 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 122.047 0.139 . . . . 25.0 111.35 167.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.19 -19.33 34.23 Favored 'Trans proline' 0 C--N 1.343 0.28 0 N-CA-C 115.614 1.351 . . . . 25.0 115.614 -177.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -82.44 4.95 22.16 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.703 -0.623 . . . . 25.0 112.398 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.1 m -68.55 -9.61 50.48 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 m -64.04 136.65 26.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 122.176 0.988 . . . . 25.0 112.916 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -153.02 160.26 42.97 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 103.742 -2.688 . . . . 25.0 103.742 177.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.84 -170.97 27.31 Favored Glycine 0 C--O 1.226 -0.389 0 N-CA-C 108.439 -1.865 . . . . 25.0 108.439 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.74 145.35 49.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 118.811 1.306 . . . . 25.0 112.142 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -66.57 156.98 33.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.24 1.66 2.81 Favored Glycine 0 C--O 1.224 -0.528 0 CA-C-N 114.921 -1.036 . . . . 25.0 113.114 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -76.06 140.86 70.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 121.633 -0.922 . . . . 25.0 108.848 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -92.66 -15.41 17.52 Favored 'Cis proline' 0 CA--C 1.544 0.993 0 N-CA-C 115.603 1.347 . . . . 25.0 115.603 -5.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.87 -36.3 72.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.878 1.436 . . . . 25.0 114.878 -169.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.15 30.21 7.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 105.612 -1.996 . . . . 25.0 105.612 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.57 -177.2 40.0 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 114.376 -1.284 . . . . 25.0 110.835 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -62.3 170.75 6.12 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.706 2.27 . . . . 25.0 113.445 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 159.95 31.1 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.381 -1.34 . . . . 25.0 107.381 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -61.41 139.08 58.26 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.767 -1.568 . . . . 25.0 106.767 174.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.52 -6.1 83.09 Favored Glycine 0 C--O 1.228 -0.228 0 CA-C-N 116.047 -0.524 . . . . 25.0 112.439 -173.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -126.2 11.19 7.54 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.53 -0.394 . . . . 25.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.28 -52.18 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 122.209 -0.307 . . . . 25.0 111.556 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.59 -21.52 57.74 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.75 -0.463 . . . . 25.0 109.75 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.6 p -81.94 -8.87 59.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.1 32.01 12.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.519 0.728 . . . . 25.0 110.292 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.94 36.83 24.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.557 1.317 . . . . 25.0 114.557 -176.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -119.82 133.31 55.64 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.927 0.491 . . . . 25.0 110.615 175.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.4 p -61.12 -33.08 72.81 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.126 1.158 . . . . 25.0 114.126 -175.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -66.24 -15.97 63.63 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.48 0.657 . . . . 25.0 112.076 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -117.25 14.31 14.78 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.744 -0.835 . . . . 25.0 108.744 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -71.16 -38.76 72.17 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.895 -1.128 . . . . 25.0 111.325 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.3 mp0 -71.31 -13.66 61.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.803 0.811 . . . . 25.0 109.677 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 mp -88.02 -4.65 58.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.693 -0.854 . . . . 25.0 108.693 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -113.11 -32.58 6.28 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.842 0.682 . . . . 25.0 112.842 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -97.09 123.08 40.75 Favored 'General case' 0 CA--C 1.507 -0.71 0 O-C-N 121.534 -0.729 . . . . 25.0 109.845 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.445 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -124.96 160.94 27.75 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.193 -0.912 . . . . 25.0 110.006 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -119.01 161.14 37.97 Favored Pre-proline 0 C--N 1.317 -0.815 1 N-CA-C 100.087 -4.042 . . . . 25.0 100.087 163.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.41 -5.31 15.68 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 116.924 -1.584 . . . . 25.0 115.64 -174.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.6 t -124.64 10.73 8.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.198 0.523 . . . . 25.0 111.7 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -78.17 -30.14 48.95 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.726 -0.609 . . . . 25.0 112.474 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.445 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.0 m95 -123.74 165.4 17.33 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.536 0.208 . . . . 25.0 110.646 -177.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -68.12 128.51 36.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.79 -1.929 . . . . 25.0 105.79 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.5 mmtt -101.33 106.49 17.67 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 100.929 -3.73 . . . . 25.0 100.929 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.02 135.58 52.51 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.022 -0.99 . . . . 25.0 110.511 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -89.88 101.49 14.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.738 -1.119 . . . . 25.0 107.985 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -130.68 173.86 10.49 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.632 -1.247 . . . . 25.0 107.632 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -114.69 161.9 17.51 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.275 0.843 . . . . 25.0 113.275 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 71.3 p -78.15 172.49 13.47 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 106.593 -1.632 . . . . 25.0 106.593 171.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.37 -162.38 32.0 Favored Glycine 0 C--O 1.241 0.562 0 N-CA-C 110.825 -0.91 . . . . 25.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.62 129.91 34.67 Favored 'Trans proline' 0 C--N 1.345 0.382 0 CA-C-N 118.961 1.38 . . . . 25.0 114.514 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -138.71 160.11 40.44 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.6 p -106.44 152.34 23.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -135.82 100.93 4.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.475 -2.417 . . . . 25.0 104.475 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.89 106.99 18.02 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.304 -0.862 . . . . 25.0 110.446 -176.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -92.8 146.94 23.26 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.62 -0.718 . . . . 25.0 109.944 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -127.53 116.08 19.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 103.937 -2.616 . . . . 25.0 103.937 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -116.42 125.6 52.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.535 -0.757 . . . . 25.0 112.689 -173.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.4 t -87.62 5.33 40.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.314 0.578 . . . . 25.0 110.245 173.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.61 116.74 21.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.93 0.395 . . . . 25.0 110.366 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -79.84 2.88 21.47 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.92 153.18 42.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.698 -0.482 . . . . 25.0 109.698 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 156.01 39.72 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.533 0.938 . . . . 25.0 113.533 -172.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.0 t -99.64 158.91 15.43 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.215 -1.031 . . . . 25.0 108.215 174.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.91 -15.31 10.0 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.161 0.288 . . . . 25.0 111.25 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.6 t -171.89 153.21 3.18 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.939 0.4 . . . . 25.0 111.951 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -125.72 139.66 53.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 104.404 -2.443 . . . . 25.0 104.404 167.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -145.01 151.42 38.54 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.342 -0.984 . . . . 25.0 108.342 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -138.01 135.04 35.55 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.12 161.71 41.42 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 118.35 0.523 . . . . 25.0 109.973 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.34 162.59 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 113.757 1.021 . . . . 25.0 113.757 -167.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -76.74 161.23 28.66 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.648 -1.242 . . . . 25.0 107.648 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.93 157.52 40.16 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.147 -0.933 . . . . 25.0 110.202 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -67.75 -19.7 47.0 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 117.858 -0.961 . . . . 25.0 114.285 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -120.98 31.99 6.16 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 122.819 0.448 . . . . 25.0 111.64 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.512 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.72 163.99 27.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.942 0.877 . . . . 25.0 112.942 -176.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.33 101.02 11.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.433 -1.258 . . . . 25.0 110.348 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -86.5 17.35 3.89 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.828 2.158 . . . . 25.0 116.828 -169.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.8 t -125.4 6.72 7.68 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.689 0.757 . . . . 25.0 109.315 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -107.72 158.45 33.35 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.7 -1.137 . . . . 25.0 108.416 -173.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -66.53 156.12 66.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 O-C-N 121.961 0.453 . . . . 25.0 111.812 178.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -70.33 100.1 1.67 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.123 0.487 . . . . 25.0 112.033 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.6 p -93.51 152.72 18.87 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.648 -1.241 . . . . 25.0 107.648 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -66.14 -25.19 66.86 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.745 -0.597 . . . . 25.0 111.073 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.29 65.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.306 -0.861 . . . . 25.0 112.235 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.5 t -82.02 -5.51 58.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.319 0.489 . . . . 25.0 112.319 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -103.87 154.24 19.84 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 114.673 1.36 . . . . 25.0 114.673 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -94.87 95.65 8.81 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 103.013 -2.958 . . . . 25.0 103.013 163.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.97 -7.03 19.29 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.109 1.152 . . . . 25.0 114.109 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.68 118.75 73.39 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.89 -0.781 . . . . 25.0 108.89 176.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.36 141.31 42.49 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 115.403 -2.598 . . . . 25.0 111.804 179.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -89.98 -12.97 37.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.523 0.564 . . . . 25.0 112.523 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.6 m -149.11 66.11 1.03 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.488 -0.324 . . . . 25.0 111.259 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -88.99 132.52 34.69 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.749 -1.181 . . . . 25.0 109.018 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -123.03 99.19 6.25 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.664 -2.347 . . . . 25.0 104.664 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -90.27 92.06 8.76 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.418 -1.327 . . . . 25.0 107.418 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -104.48 118.17 35.94 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.979 -1.489 . . . . 25.0 106.979 177.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.84 80.53 0.4 Allowed Glycine 0 CA--C 1.503 -0.696 0 CA-C-N 115.396 -0.82 . . . . 25.0 113.48 -170.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.47 15.18 6.03 Favored Glycine 0 C--N 1.322 -0.25 0 C-N-CA 120.916 -0.659 . . . . 25.0 113.661 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.48 104.82 5.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.563 0.697 . . . . 25.0 109.689 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.38 123.23 89.26 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 106.092 -1.818 . . . . 25.0 106.092 176.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.68 161.39 44.06 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 118.352 -0.632 . . . . 25.0 113.739 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.44 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.58 26.61 3.38 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.965 -1.124 . . . . 25.0 107.965 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.13 -15.45 0.41 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.975 1.71 . . . . 25.0 111.947 -174.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.44 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.3 mt-30 -129.43 151.01 50.53 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 103.776 -2.675 . . . . 25.0 103.776 169.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.46 95.0 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 122.382 1.087 . . . . 25.0 108.633 -178.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.8 m -87.36 124.72 33.69 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -118.4 162.44 18.32 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 105.27 -2.122 . . . . 25.0 105.27 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -133.95 146.35 50.4 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 103.81 -2.663 . . . . 25.0 103.81 171.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.22 158.81 27.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.986 -1.116 . . . . 25.0 107.986 -176.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -102.13 117.0 33.86 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.119 0.262 . . . . 25.0 110.67 -177.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.5 mt -75.31 132.13 76.72 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 107.238 -1.393 . . . . 25.0 107.238 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.89 145.93 96.7 Favored 'Trans proline' 0 C--N 1.352 0.742 0 CA-C-O 121.753 0.647 . . . . 25.0 113.492 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.11 -25.83 39.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.093 -0.958 . . . . 25.0 112.48 -168.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -84.01 9.12 13.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.697 -0.683 . . . . 25.0 110.165 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -116.0 51.26 0.97 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.837 0.827 . . . . 25.0 108.966 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.9 p -86.11 165.2 16.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.868 -1.53 . . . . 25.0 106.868 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.29 -169.09 32.83 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 114.541 0.576 . . . . 25.0 114.541 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.0 114.36 22.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.433 0.635 . . . . 25.0 111.116 -168.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.96 170.46 21.3 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.725 -0.671 . . . . 25.0 110.657 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -105.85 150.61 8.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 107.406 -1.331 . . . . 25.0 107.406 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 50.1 mt -131.45 120.21 45.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.214 -2.143 . . . . 25.0 105.214 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.78 130.07 49.64 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.453 -0.794 . . . . 25.0 109.545 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -116.66 129.74 56.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.72 140.18 48.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.154 0.978 . . . . 25.0 112.028 -177.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -114.53 117.36 30.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 106.43 -1.693 . . . . 25.0 106.43 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.08 126.49 42.28 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.5 mm -81.79 141.62 14.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.453 -0.573 . . . . 25.0 109.453 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.58 -42.39 22.37 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.767 0.712 . . . . 25.0 110.394 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.09 -24.08 65.0 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.583 0.957 . . . . 25.0 113.583 -172.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.7 p -139.32 170.54 15.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.966 0.889 . . . . 25.0 110.21 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.22 23.64 0.58 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.125 -0.943 . . . . 25.0 112.21 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -94.32 147.48 23.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.691 -0.631 . . . . 25.0 112.606 -176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.19 143.24 12.08 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.053 -2.203 . . . . 25.0 105.053 172.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -146.66 136.03 22.82 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.997 0.74 . . . . 25.0 112.997 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -93.98 114.8 27.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.524 -0.762 . . . . 25.0 111.54 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . 0.448 ' HB3' ' HG ' ' A' ' 9' ' ' SER . 76.0 mt-30 -97.05 113.37 24.91 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.21 140.71 29.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.043 -0.526 . . . . 25.0 112.051 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.5 tt -125.13 135.47 63.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.787 -1.931 . . . . 25.0 105.787 167.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -95.31 131.2 41.67 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.766 -1.198 . . . . 25.0 107.766 176.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.5 m -132.76 163.23 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 113.103 0.779 . . . . 25.0 113.103 -175.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -119.53 95.04 4.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 104.386 -2.45 . . . . 25.0 104.386 167.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.3 tp -90.03 163.96 14.7 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 112.689 0.625 . . . . 25.0 112.689 -172.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.5 p -144.33 156.74 44.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.153 -1.054 . . . . 25.0 108.153 175.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.379 -0.82 . . . . 25.0 112.416 -175.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.7 m170 . . . . . 0 N--CA 1.484 1.237 0 CA-C-O 121.372 0.606 . . . . 25.0 110.761 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.26 168.76 34.14 Favored Glycine 0 N--CA 1.451 -0.32 1 N-CA-C 100.85 -4.9 . . . . 25.0 100.85 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -146.69 162.64 38.06 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 120.374 2.087 . . . . 25.0 110.507 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -99.34 122.6 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.979 -1.119 . . . . 25.0 107.979 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -73.42 -42.95 61.41 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.801 -1.09 . . . . 25.0 109.593 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -152.62 129.56 5.61 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 106.129 -1.804 . . . . 25.0 106.129 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.67 133.37 16.49 Favored 'Cis proline' 0 CA--C 1.534 0.495 0 C-N-CA 128.577 0.657 . . . . 25.0 111.476 -0.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.52 110.72 3.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 25.0 112.409 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 156.81 38.74 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.275 -0.639 . . . . 25.0 109.275 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -56.3 -24.77 45.54 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.642 0.777 . . . . 25.0 112.656 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.99 -49.89 58.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.771 0.796 . . . . 25.0 109.066 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -66.22 -37.43 85.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.468 -0.787 . . . . 25.0 109.888 177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -63.17 -33.1 74.73 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 122.258 -0.276 . . . . 25.0 110.808 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -39.07 91.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 25.0 110.235 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 tmtm? -67.67 -35.92 79.76 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.565 -0.531 . . . . 25.0 109.565 177.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.9 mt -77.37 4.09 11.65 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.21 -0.45 . . . . 25.0 111.599 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 58.19 22.44 9.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.306 1.443 . . . . 25.0 113.265 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.446 ' C ' HD21 ' A' ' 19' ' ' ASN . 93.1 mt -85.03 -21.09 29.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.242 -1.392 . . . . 25.0 107.242 173.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.446 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.04 158.16 32.81 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.2 p -136.77 175.34 9.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.112 -0.329 . . . . 25.0 110.112 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 72.11 4.91 5.17 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.423 1.638 . . . . 25.0 115.423 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -66.63 -38.26 86.55 Favored 'General case' 0 CA--C 1.501 -0.918 0 O-C-N 121.823 -0.548 . . . . 25.0 110.972 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -63.49 1.42 Allowed Glycine 0 C--O 1.218 -0.854 0 O-C-N 123.753 0.658 . . . . 25.0 112.271 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.9 t -87.81 -54.35 4.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.571 1.177 . . . . 25.0 111.37 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -68.83 -7.01 6.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.236 -1.347 . . . . 25.0 113.82 -171.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -91.51 0.3 57.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.848 -0.533 . . . . 25.0 111.261 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -116.02 -34.08 4.85 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.904 -0.719 . . . . 25.0 109.893 173.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -126.91 101.75 25.83 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 109.284 -0.636 . . . . 25.0 109.284 169.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -73.24 -20.4 21.37 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 117.108 -1.461 . . . . 25.0 114.53 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -86.17 11.87 10.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.338 0.495 . . . . 25.0 112.338 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.1 m -65.18 -12.42 50.96 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.1 130.24 28.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 122.135 0.969 . . . . 25.0 112.919 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -152.96 151.07 29.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 104.975 -2.232 . . . . 25.0 104.975 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.65 -169.38 22.89 Favored Glycine 0 C--O 1.229 -0.216 0 N-CA-C 109.755 -1.338 . . . . 25.0 109.755 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.42 147.83 49.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 118.051 0.926 . . . . 25.0 111.725 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -65.99 157.04 31.87 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.883 -1.154 . . . . 25.0 107.883 172.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.58 -4.01 1.66 Allowed Glycine 0 C--N 1.317 -0.494 0 CA-C-N 114.773 -1.103 . . . . 25.0 112.91 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -75.76 144.58 76.9 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 121.689 -0.889 . . . . 25.0 109.116 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -91.54 -17.86 14.83 Favored 'Cis proline' 0 CA--C 1.543 0.962 0 N-CA-C 116.041 1.516 . . . . 25.0 116.041 -5.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.6 -37.44 62.88 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.913 1.449 . . . . 25.0 114.913 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -116.47 32.29 6.22 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.212 -1.773 . . . . 25.0 106.212 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.59 -176.94 47.0 Favored Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 114.591 -1.186 . . . . 25.0 110.744 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.95 171.54 3.68 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.982 2.455 . . . . 25.0 113.095 177.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.11 160.07 30.9 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.726 -1.213 . . . . 25.0 107.726 174.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.75 139.62 57.14 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 106.038 -1.838 . . . . 25.0 106.038 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.4 -8.02 76.33 Favored Glycine 0 C--O 1.229 -0.163 0 CA-C-N 116.403 -0.362 . . . . 25.0 112.666 -173.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -126.18 9.5 7.37 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.396 -0.473 . . . . 25.0 111.329 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.86 -49.53 83.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 122.151 -0.343 . . . . 25.0 111.166 -174.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -20.9 57.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.98 0.419 . . . . 25.0 110.266 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -84.73 -8.57 58.79 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.995 0.739 . . . . 25.0 112.995 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 33.31 13.65 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.53 0.732 . . . . 25.0 110.043 -172.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.47 39.24 25.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.816 1.414 . . . . 25.0 114.816 -177.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -120.55 137.55 54.33 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.105 0.562 . . . . 25.0 110.714 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.0 p -62.95 -36.28 82.95 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 115.617 1.71 . . . . 25.0 115.617 -173.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 t -72.29 -5.01 33.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -177.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -121.14 12.5 11.08 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -72.23 -36.5 69.12 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.051 -1.031 . . . . 25.0 110.106 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -71.69 -11.07 60.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.496 -0.774 . . . . 25.0 109.715 175.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 mp -93.95 -1.3 54.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.822 -0.807 . . . . 25.0 108.822 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -116.26 -32.02 5.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.567 0.58 . . . . 25.0 112.567 174.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -92.22 131.77 37.19 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 107.453 -1.314 . . . . 25.0 107.453 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.476 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.3 pm0 -137.56 160.61 38.69 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.405 -0.816 . . . . 25.0 111.443 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 52.8 p -119.99 159.57 46.42 Favored Pre-proline 0 C--O 1.242 0.667 1 N-CA-C 100.068 -4.049 . . . . 25.0 100.068 159.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -70.32 -6.37 18.72 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 116.281 -2.012 . . . . 25.0 115.558 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.2 t -114.5 2.1 14.51 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.636 0.606 . . . . 25.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -78.33 -28.13 47.26 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.088 0.773 . . . . 25.0 113.088 -175.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.476 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.5 m95 -124.5 163.13 22.5 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 120.581 0.229 . . . . 25.0 110.608 -177.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.31 129.49 40.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 106.158 -1.793 . . . . 25.0 106.158 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -101.86 107.56 18.78 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 100.231 -3.989 . . . . 25.0 100.231 177.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -68.37 134.48 50.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.242 -0.89 . . . . 25.0 110.141 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -92.63 100.78 13.23 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 25.0 108.0 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.5 mt -131.17 173.99 10.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.106 -1.072 . . . . 25.0 108.106 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.23 154.33 25.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 111.519 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 58.9 p -77.04 168.37 20.2 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 173.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 96.61 -161.86 22.2 Favored Glycine 0 C--O 1.241 0.564 0 N-CA-C 110.366 -1.094 . . . . 25.0 110.366 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.95 132.29 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 CA-C-N 119.057 1.429 . . . . 25.0 113.482 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.94 160.76 38.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.473 -1.677 . . . . 25.0 106.473 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 p -101.37 151.1 22.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.686 -1.227 . . . . 25.0 107.686 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -138.02 100.97 4.3 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.074 -2.195 . . . . 25.0 105.074 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.07 114.33 28.15 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.356 -0.838 . . . . 25.0 110.038 -176.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -101.5 150.96 22.53 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.526 -0.761 . . . . 25.0 110.631 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -126.63 116.46 21.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 104.092 -2.559 . . . . 25.0 104.092 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.76 126.64 55.64 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.547 -0.751 . . . . 25.0 110.952 -174.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.3 t -89.01 13.9 11.85 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.44 0.638 . . . . 25.0 110.565 176.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -133.68 138.75 46.03 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.94 -0.475 . . . . 25.0 109.855 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -86.09 -7.67 58.43 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.681 0.623 . . . . 25.0 112.681 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.77 157.92 31.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.4 t -76.98 156.0 32.22 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 114.809 1.411 . . . . 25.0 114.809 -172.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -97.14 159.41 14.93 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 172.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -117.81 -14.54 10.11 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 123.127 0.267 . . . . 25.0 111.263 171.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -172.19 152.85 2.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.947 0.403 . . . . 25.0 111.335 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -125.43 136.91 53.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 167.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -142.04 150.19 40.94 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.044 -1.095 . . . . 25.0 108.044 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -136.57 133.6 36.56 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.03 164.14 35.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.334 0.515 . . . . 25.0 110.595 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.91 164.81 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.331 0.863 . . . . 25.0 113.331 -166.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.6 p -81.33 162.92 23.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.286 -1.375 . . . . 25.0 107.286 168.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -61.27 157.71 42.21 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.468 -0.787 . . . . 25.0 108.996 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -69.0 -22.33 35.75 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 116.464 -1.891 . . . . 25.0 114.021 -173.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -114.05 31.9 6.24 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.322 0.49 . . . . 25.0 112.322 -173.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.501 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.5 p-90 -80.42 163.31 23.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.527 0.68 . . . . 25.0 110.106 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -87.28 101.08 13.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.309 -0.86 . . . . 25.0 110.324 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.501 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.19 22.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 115.253 1.575 . . . . 25.0 115.253 -174.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.1 t -118.93 1.09 11.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.565 0.697 . . . . 25.0 109.852 175.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -112.51 160.0 32.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 107.937 -1.135 . . . . 25.0 107.937 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.36 159.48 43.67 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 120.431 0.754 . . . . 25.0 112.592 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.4 mp -68.12 117.12 9.54 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 122.189 -0.32 . . . . 25.0 110.293 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.5 p -114.41 150.59 34.45 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.578 -0.897 . . . . 25.0 108.578 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.8 ptp180 -64.57 -24.9 67.75 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.977 -0.452 . . . . 25.0 111.621 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.54 72.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.699 -0.682 . . . . 25.0 111.999 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 85.0 p -88.98 -3.01 58.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.111 -0.495 . . . . 25.0 111.978 -178.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -97.28 150.81 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.941 1.46 . . . . 25.0 114.941 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.23 96.15 8.22 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 102.883 -3.006 . . . . 25.0 102.883 162.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.26 0.63 7.52 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.142 1.164 . . . . 25.0 114.142 -171.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 10.2 t -98.19 134.46 22.01 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.197 -0.668 . . . . 25.0 109.197 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 146.81 37.99 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 116.447 -1.902 . . . . 25.0 112.29 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -97.1 -6.63 34.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.995 0.426 . . . . 25.0 111.335 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 36.0 m -151.71 71.61 0.99 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -88.88 131.35 35.15 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 119.172 -1.011 . . . . 25.0 109.628 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -122.03 99.06 6.23 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 103.465 -2.791 . . . . 25.0 103.465 176.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -92.8 91.95 7.71 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.433 -1.321 . . . . 25.0 107.433 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -113.74 118.56 34.66 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.81 81.8 0.36 Allowed Glycine 0 CA--C 1.501 -0.841 0 CA-C-N 115.551 -0.749 . . . . 25.0 112.901 -170.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.47 16.06 5.24 Favored Glycine 0 C--N 1.32 -0.342 0 C-N-CA 120.931 -0.652 . . . . 25.0 113.699 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.88 104.03 4.61 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.579 0.704 . . . . 25.0 109.449 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.7 126.23 90.82 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 106.376 -1.712 . . . . 25.0 106.376 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.09 171.13 18.91 Favored 'Trans proline' 0 C--N 1.344 0.294 0 N-CA-C 113.573 0.566 . . . . 25.0 113.573 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.55 29.84 5.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.687 -1.227 . . . . 25.0 107.687 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.08 -15.04 0.35 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.894 1.678 . . . . 25.0 111.868 -173.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.464 ' H ' ' C ' ' A' ' 128' ' ' ALA . 68.4 mt-30 -129.0 154.69 46.37 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 103.416 -2.809 . . . . 25.0 103.416 170.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.4 t -140.48 94.98 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.577 0 N-CA-C 106.266 -1.753 . . . . 25.0 106.266 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.14 145.57 27.56 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 104.43 -2.433 . . . . 25.0 104.43 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.04 166.98 31.8 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.493 -1.685 . . . . 25.0 108.217 -178.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -136.14 154.3 51.02 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.95 160.55 30.92 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.769 -1.567 . . . . 25.0 106.769 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -103.38 115.55 30.76 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.018 0.199 . . . . 25.0 111.004 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.71 130.33 73.89 Favored Pre-proline 0 C--O 1.239 0.519 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.69 147.22 95.02 Favored 'Trans proline' 0 C--N 1.351 0.683 0 CA-C-O 121.729 0.637 . . . . 25.0 113.232 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.22 38.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.188 -0.915 . . . . 25.0 112.554 -169.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.4 p-10 -85.02 9.57 14.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.65 -0.705 . . . . 25.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -113.51 56.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.864 -1.161 . . . . 25.0 107.864 170.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.2 p -86.18 170.79 11.83 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 106.968 -1.493 . . . . 25.0 106.968 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 82.25 -165.42 44.94 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 116.926 1.53 . . . . 25.0 116.926 174.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.4 t -86.04 106.47 17.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.295 0.569 . . . . 25.0 110.962 -168.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.471 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.6 p-80 -157.96 172.43 18.46 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.082 -0.508 . . . . 25.0 111.306 -176.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.8 p -102.87 150.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.786 -1.19 . . . . 25.0 107.786 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.9 mt -134.84 129.6 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 N-CA-C 101.487 -3.523 . . . . 25.0 101.487 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -120.28 139.71 52.31 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 109.78 -0.452 . . . . 25.0 109.78 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -120.6 134.26 55.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.073 -0.714 . . . . 25.0 109.073 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.25 139.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 122.165 0.983 . . . . 25.0 112.02 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -109.45 113.2 25.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.299 -1.741 . . . . 25.0 106.299 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 122.22 35.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.735 -1.209 . . . . 25.0 107.735 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.8 mm -78.52 142.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.388 -0.597 . . . . 25.0 109.388 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.23 -43.19 24.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.819 0.736 . . . . 25.0 110.224 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.01 -23.47 65.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.755 -1.111 . . . . 25.0 113.898 -172.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.0 p -139.82 170.4 15.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.045 0.926 . . . . 25.0 110.299 -175.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.6 20.04 0.96 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.115 -0.948 . . . . 25.0 112.232 177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.13 146.07 24.57 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.617 -0.677 . . . . 25.0 112.491 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.41 143.46 11.87 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.385 -2.08 . . . . 25.0 105.385 172.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -146.6 130.9 17.53 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 111.772 0.286 . . . . 25.0 111.772 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -88.95 115.76 26.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.868 -0.605 . . . . 25.0 110.663 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.02 20.67 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.691 -0.855 . . . . 25.0 108.691 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.68 143.43 33.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 25.0 112.552 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -129.0 134.94 63.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 105.135 -2.172 . . . . 25.0 105.135 166.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -94.45 130.93 40.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.84 162.26 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 112.973 0.731 . . . . 25.0 112.973 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -120.38 95.12 4.6 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.362 -2.459 . . . . 25.0 104.362 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.9 tp -90.5 162.81 14.88 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 113.274 0.842 . . . . 25.0 113.274 -171.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.3 p -145.26 164.42 31.46 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.72 0 CA-C-O 117.966 -1.016 . . . . 25.0 110.785 -178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.2 m80 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.328 0.585 . . . . 25.0 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.59 169.79 38.38 Favored Glycine 0 CA--C 1.508 -0.357 1 N-CA-C 102.54 -4.224 . . . . 25.0 102.54 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 p90 -144.16 160.01 41.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 119.954 1.877 . . . . 25.0 110.461 178.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.24 121.14 47.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.48 -40.94 56.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.515 -1.22 . . . . 25.0 109.972 -174.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.6 t -153.7 128.68 4.88 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 105.77 -1.937 . . . . 25.0 105.77 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.19 130.6 11.28 Favored 'Cis proline' 0 C--N 1.348 0.512 0 C-N-CA 128.554 0.648 . . . . 25.0 111.099 -0.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 114.48 5.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.106 -0.497 . . . . 25.0 112.263 -172.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.1 t -71.86 158.64 35.69 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 108.628 -0.878 . . . . 25.0 108.628 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -54.6 -26.33 31.93 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.578 0.751 . . . . 25.0 111.81 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.97 -53.45 38.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.678 0.752 . . . . 25.0 109.327 175.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.09 -34.86 78.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.733 -0.667 . . . . 25.0 110.558 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -63.45 -33.14 74.9 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 122.174 -0.329 . . . . 25.0 110.548 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -40.03 95.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.319 0.581 . . . . 25.0 109.617 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 tmtm? -68.3 -33.85 75.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.081 -0.509 . . . . 25.0 110.395 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.91 5.21 14.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.454 176.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 58.83 23.23 11.05 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.098 1.359 . . . . 25.0 113.053 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.468 ' C ' HD21 ' A' ' 19' ' ' ASN . 90.4 mt -88.44 -21.24 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.818 -1.178 . . . . 25.0 107.818 174.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.468 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.31 160.17 28.65 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.687 -2.338 . . . . 25.0 104.687 176.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -136.42 174.8 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.247 -0.279 . . . . 25.0 110.247 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 71.8 5.26 5.31 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.917 1.821 . . . . 25.0 115.917 173.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.3 m -67.35 -35.2 78.89 Favored 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 121.555 -0.716 . . . . 25.0 111.045 174.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.4 -64.3 1.38 Allowed Glycine 0 C--O 1.217 -0.918 0 O-C-N 123.818 0.699 . . . . 25.0 112.185 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 t -87.89 -54.09 4.42 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.621 1.2 . . . . 25.0 111.176 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.73 -8.27 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.151 -1.386 . . . . 25.0 113.164 -171.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.81 1.75 54.73 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.976 -0.453 . . . . 25.0 111.505 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.51 -34.88 3.68 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.713 -0.795 . . . . 25.0 110.427 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -127.12 100.57 26.77 Favored Pre-proline 0 C--O 1.241 0.636 0 C-N-CA 122.132 0.173 . . . . 25.0 111.163 169.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.05 -21.28 18.36 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 117.141 -1.439 . . . . 25.0 114.505 -176.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -83.83 11.98 6.75 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.697 0.629 . . . . 25.0 112.697 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -68.99 -16.22 63.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.739 0.304 . . . . 25.0 111.77 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.68 137.69 24.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 113.983 1.105 . . . . 25.0 113.983 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -152.97 152.99 32.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 106.156 -1.794 . . . . 25.0 106.156 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -155.34 -168.31 18.27 Favored Glycine 0 C--O 1.229 -0.206 0 N-CA-C 108.694 -1.763 . . . . 25.0 108.694 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.6 tp -127.8 147.31 50.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 118.325 1.063 . . . . 25.0 111.704 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -66.47 156.89 33.52 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 172.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 1.84 3.84 Favored Glycine 0 C--O 1.225 -0.43 0 CA-C-N 114.962 -1.017 . . . . 25.0 113.255 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.95 145.1 77.05 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 121.732 -0.864 . . . . 25.0 109.691 -176.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -91.63 -16.07 18.36 Favored 'Cis proline' 0 CA--C 1.54 0.823 0 N-CA-C 115.119 1.161 . . . . 25.0 115.119 -6.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -71.8 -35.68 70.06 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.711 1.374 . . . . 25.0 114.711 -169.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.43 30.97 6.99 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.508 -2.034 . . . . 25.0 105.508 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.31 -173.43 40.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 114.259 -1.337 . . . . 25.0 111.131 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.11 171.61 4.91 Favored 'Trans proline' 0 C--O 1.242 0.685 0 C-N-CA 123.099 2.532 . . . . 25.0 113.713 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.01 159.94 31.15 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.649 -1.612 . . . . 25.0 106.649 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.42 138.81 58.27 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.385 -1.28 . . . . 25.0 107.864 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.83 -4.32 82.89 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-O 121.408 0.449 . . . . 25.0 112.794 -174.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.4 m170 -124.19 10.23 8.69 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.171 -0.678 . . . . 25.0 109.171 177.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.0 mt -65.32 -50.16 74.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 122.361 -0.212 . . . . 25.0 111.509 -173.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.64 -20.35 58.56 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.811 -0.556 . . . . 25.0 110.124 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.0 p -83.54 -8.27 59.37 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.434 0.531 . . . . 25.0 112.434 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.42 34.02 14.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.627 0.771 . . . . 25.0 110.168 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.4 OUTLIER 58.07 39.74 25.96 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.734 1.383 . . . . 25.0 114.734 -177.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -120.74 134.4 55.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.174 0.59 . . . . 25.0 110.752 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -62.38 -34.34 76.51 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.698 1.37 . . . . 25.0 114.698 -175.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 t -70.49 -8.33 50.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.488 0.551 . . . . 25.0 112.488 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -120.84 13.76 11.53 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.479 -1.304 . . . . 25.0 107.479 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -72.4 -37.18 68.75 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.056 -1.028 . . . . 25.0 110.455 -176.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -71.45 -13.7 61.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.721 0.772 . . . . 25.0 109.084 174.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 mp -90.17 -3.78 57.66 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.673 -0.694 . . . . 25.0 109.142 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -113.95 -34.21 5.5 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -92.82 119.91 32.64 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 121.596 -0.69 . . . . 25.0 110.312 -178.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.485 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.14 160.96 25.38 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.213 -0.903 . . . . 25.0 108.888 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.8 p -117.77 162.67 27.88 Favored Pre-proline 0 C--N 1.316 -0.857 1 N-CA-C 99.671 -4.196 . . . . 25.0 99.671 162.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.84 -4.91 14.29 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 116.782 -1.679 . . . . 25.0 115.687 -175.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -125.54 11.53 7.97 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.228 0.537 . . . . 25.0 111.783 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -77.46 -28.21 52.33 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.868 0.692 . . . . 25.0 112.868 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.485 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.5 m95 -125.88 165.41 18.78 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 110.145 -0.317 . . . . 25.0 110.145 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -66.87 126.54 29.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.23 -2.137 . . . . 25.0 105.23 168.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -94.86 104.89 16.79 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 100.294 -3.965 . . . . 25.0 100.294 177.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.79 134.87 54.03 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.654 -1.157 . . . . 25.0 110.098 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -93.26 99.37 11.93 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.585 -1.265 . . . . 25.0 107.585 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.9 mt -129.68 173.83 10.26 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.669 -1.975 . . . . 25.0 105.669 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -116.73 163.35 16.27 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -178.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 73.8 p -77.48 172.88 12.65 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.653 -1.612 . . . . 25.0 107.086 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.54 -162.62 31.94 Favored Glycine 0 C--O 1.24 0.479 0 N-CA-C 111.125 -0.79 . . . . 25.0 111.125 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.13 130.25 35.44 Favored 'Trans proline' 0 C--N 1.346 0.418 0 CA-C-N 118.8 1.3 . . . . 25.0 113.667 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -137.52 158.59 44.06 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.51 -1.663 . . . . 25.0 106.51 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 p -96.22 150.31 20.68 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -135.3 100.94 4.67 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 104.512 -2.403 . . . . 25.0 104.512 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.72 114.64 28.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.911 0.862 . . . . 25.0 109.521 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -100.08 146.99 26.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.3 -0.864 . . . . 25.0 109.492 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.31 114.39 18.19 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 103.624 -2.732 . . . . 25.0 103.624 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.8 mp -111.93 133.15 54.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.596 -0.729 . . . . 25.0 110.83 -172.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -99.19 17.85 18.92 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.763 0.792 . . . . 25.0 109.049 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.58 133.74 50.99 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.201 -0.666 . . . . 25.0 109.201 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -87.27 -17.21 33.06 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.535 0.939 . . . . 25.0 113.535 -177.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -73.1 162.05 29.91 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.956 0.724 . . . . 25.0 112.956 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -66.41 155.93 36.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 116.508 2.04 . . . . 25.0 116.508 -170.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.432 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 8.2 t -101.37 158.98 15.66 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.694 -1.225 . . . . 25.0 107.694 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -117.94 -17.22 9.79 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.302 0.482 . . . . 25.0 112.302 172.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.9 t -171.09 154.38 4.06 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.503 0.556 . . . . 25.0 112.503 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.8 m95 -128.8 140.71 51.58 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 104.64 -2.355 . . . . 25.0 104.64 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.6 mtt-85 -147.43 151.7 36.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.39 -0.967 . . . . 25.0 108.39 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -137.93 138.72 39.27 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.114 -1.439 . . . . 25.0 107.114 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.66 162.77 39.56 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.284 0.493 . . . . 25.0 109.92 176.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.99 164.96 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 114.275 1.213 . . . . 25.0 114.275 -167.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 11.0 p -79.6 161.65 25.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.226 -1.027 . . . . 25.0 108.226 169.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.65 157.47 47.7 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.116 -0.947 . . . . 25.0 109.621 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.77 -18.44 36.96 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 117.444 -1.237 . . . . 25.0 114.072 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.73 31.93 6.21 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 122.791 0.436 . . . . 25.0 111.566 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -74.25 162.88 28.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.847 0.832 . . . . 25.0 111.434 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -83.64 101.06 11.24 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.736 -1.12 . . . . 25.0 110.172 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -84.81 14.09 5.16 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 116.597 2.073 . . . . 25.0 116.597 -171.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -117.93 1.91 12.1 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.833 -0.802 . . . . 25.0 108.833 175.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -105.09 158.48 32.0 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 107.832 -1.173 . . . . 25.0 107.832 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -66.65 159.44 51.0 Favored 'Trans proline' 0 C--N 1.344 0.327 0 O-C-N 122.024 0.486 . . . . 25.0 112.232 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.96 101.9 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 25.0 110.641 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.6 p -98.63 159.76 14.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.449 -0.945 . . . . 25.0 108.449 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -65.42 -25.76 67.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.097 0.475 . . . . 25.0 110.964 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -24.97 61.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.648 -0.706 . . . . 25.0 112.277 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.7 m -79.29 -12.1 59.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.754 0.311 . . . . 25.0 111.82 -178.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.42 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 42.2 m-85 -99.17 155.04 17.68 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.16 1.541 . . . . 25.0 115.16 -174.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -94.43 95.63 8.98 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 102.619 -3.104 . . . . 25.0 102.619 163.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.9 mt -69.79 20.89 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 116.428 2.011 . . . . 25.0 116.428 -169.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.0 t -114.3 137.39 22.52 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.272 -0.64 . . . . 25.0 109.272 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.77 152.07 46.91 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.208 -2.728 . . . . 25.0 111.196 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -107.9 -6.69 16.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.972 0.415 . . . . 25.0 111.688 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.5 m -152.6 70.06 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.133 -0.485 . . . . 25.0 109.911 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -89.06 135.06 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.239 -0.984 . . . . 25.0 109.172 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.01 99.12 5.98 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.765 -2.309 . . . . 25.0 104.765 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -93.24 92.06 7.55 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.931 -0.766 . . . . 25.0 108.931 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -107.42 117.06 33.1 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.671 -1.233 . . . . 25.0 107.671 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.55 80.58 0.37 Allowed Glycine 0 CA--C 1.503 -0.703 0 CA-C-N 115.799 -0.637 . . . . 25.0 113.519 -170.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.43 15.87 5.8 Favored Glycine 0 C--N 1.322 -0.237 0 C-N-CA 120.96 -0.638 . . . . 25.0 113.264 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.48 105.59 4.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.358 0.599 . . . . 25.0 109.585 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 88.8 mt -72.29 122.59 87.83 Favored Pre-proline 0 C--N 1.321 -0.673 0 N-CA-C 105.384 -2.08 . . . . 25.0 105.384 175.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.94 167.24 26.55 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 117.864 -0.957 . . . . 25.0 113.826 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.442 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -96.32 25.8 4.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.291 -1.003 . . . . 25.0 108.291 175.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.65 -12.36 0.46 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.822 1.649 . . . . 25.0 112.168 -174.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' A' ' 128' ' ' ALA . 63.7 mt-30 -130.12 152.2 49.83 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.046 -2.576 . . . . 25.0 104.046 169.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.1 t -142.94 95.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.843 -1.54 . . . . 25.0 106.843 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -86.94 141.09 28.97 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.199 -2.148 . . . . 25.0 105.199 174.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.52 167.0 26.53 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.513 -2.032 . . . . 25.0 105.513 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -134.08 152.02 51.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.04 -2.208 . . . . 25.0 105.04 172.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.3 160.33 35.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.441 -1.318 . . . . 25.0 107.441 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -103.43 116.0 31.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.597 -0.274 . . . . 25.0 111.018 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 131.24 72.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -60.91 144.21 99.52 Favored 'Trans proline' 0 C--N 1.352 0.726 0 N-CA-C 113.919 0.7 . . . . 25.0 113.919 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.23 -28.2 42.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.182 -0.917 . . . . 25.0 112.514 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -82.35 10.25 7.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.733 0.778 . . . . 25.0 110.133 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -117.78 53.43 0.94 Allowed 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.553 -1.277 . . . . 25.0 107.553 171.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.95 11.82 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 106.398 -1.704 . . . . 25.0 106.398 174.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.95 -165.15 41.47 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 116.262 1.265 . . . . 25.0 116.262 176.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -86.02 108.61 18.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.446 0.641 . . . . 25.0 111.012 -168.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -159.39 172.36 18.07 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.784 -0.644 . . . . 25.0 110.921 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -109.06 152.04 11.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.219 -1.03 . . . . 25.0 108.219 -179.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 67.8 mt -134.44 123.22 42.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 104.229 -2.508 . . . . 25.0 104.229 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.54 127.7 52.33 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 122.899 0.479 . . . . 25.0 110.261 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -111.54 129.36 56.08 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 108.816 -0.809 . . . . 25.0 108.816 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.7 p -126.72 139.75 50.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 122.172 0.987 . . . . 25.0 111.92 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.432 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 9.7 t90 -117.13 124.12 48.4 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.56 126.52 49.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.597 -0.52 . . . . 25.0 109.597 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 35.9 mm -77.85 142.47 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.93 -45.55 20.25 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.929 0.786 . . . . 25.0 110.678 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.17 -21.25 64.9 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.575 1.324 . . . . 25.0 114.575 -172.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 50.0 p -138.59 169.09 18.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.915 0.864 . . . . 25.0 109.577 -175.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.7 19.67 0.81 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.257 -0.883 . . . . 25.0 112.244 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.1 142.65 27.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -176.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.46 141.1 14.46 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 171.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -140.81 135.41 31.4 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.501 0.556 . . . . 25.0 112.501 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -93.65 112.47 24.35 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.449 -0.796 . . . . 25.0 111.149 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -97.15 108.21 20.89 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.971 -0.752 . . . . 25.0 108.971 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.11 141.75 33.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.744 -0.662 . . . . 25.0 111.737 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -125.27 132.88 70.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 105.553 -2.017 . . . . 25.0 105.553 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -96.46 129.42 43.83 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.3 162.31 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.666 0.987 . . . . 25.0 113.666 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.49 94.93 4.73 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.652 -2.721 . . . . 25.0 103.652 164.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.9 tp -91.29 156.86 17.49 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 112.844 0.683 . . . . 25.0 112.844 -170.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.4 p -145.76 168.06 21.65 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.998 -0.439 . . . . 25.0 110.886 175.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.767 0 CA-C-O 118.711 -0.661 . . . . 25.0 110.602 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 121.012 0.434 . . . . 25.0 110.548 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.92 169.4 33.9 Favored Glycine 0 CA--C 1.509 -0.327 1 N-CA-C 101.872 -4.491 . . . . 25.0 101.872 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -145.75 161.49 39.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 120.188 1.994 . . . . 25.0 110.278 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -97.99 122.96 50.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.809 -1.182 . . . . 25.0 107.809 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -73.19 -43.34 61.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.999 -1.001 . . . . 25.0 109.424 -176.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.7 t -153.29 131.36 6.33 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.16 -1.793 . . . . 25.0 106.16 177.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.96 134.18 19.1 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.498 0.624 . . . . 25.0 111.395 -0.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.26 109.83 2.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.001 -0.545 . . . . 25.0 112.239 -172.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.6 t -71.94 157.55 37.63 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.947 -0.76 . . . . 25.0 108.947 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -55.86 -24.36 36.34 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.439 0.695 . . . . 25.0 111.812 178.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.54 -53.28 36.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.711 0.767 . . . . 25.0 109.279 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.01 -37.18 85.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.489 -0.778 . . . . 25.0 110.277 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -62.97 -32.82 74.23 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 120.991 -0.284 . . . . 25.0 110.814 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.05 94.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.086 0.47 . . . . 25.0 110.53 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.439 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.0 tmtm? -70.07 -33.42 71.9 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.05 0.452 . . . . 25.0 110.047 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.65 3.62 11.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.481 174.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.03 10.09 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.39 1.476 . . . . 25.0 113.05 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.8 mt -85.86 -22.28 27.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.196 -1.409 . . . . 25.0 107.196 173.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.425 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.5 m120 -123.3 158.78 30.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 105.004 -2.221 . . . . 25.0 105.004 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.6 p -135.95 177.76 7.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.463 -0.569 . . . . 25.0 109.463 -176.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 72.02 4.97 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.498 1.666 . . . . 25.0 115.498 173.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.4 m -69.95 -37.15 75.76 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.484 -0.76 . . . . 25.0 111.647 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.22 -63.5 1.72 Allowed Glycine 0 C--O 1.219 -0.838 0 O-C-N 123.474 0.484 . . . . 25.0 112.192 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.0 t -88.04 -53.33 4.78 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.392 1.092 . . . . 25.0 111.544 -178.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -10.56 13.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.447 -1.251 . . . . 25.0 113.054 -171.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -87.71 2.28 51.54 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.902 -0.499 . . . . 25.0 112.101 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -120.07 -34.74 3.62 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.756 -0.778 . . . . 25.0 110.677 172.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.05 105.32 22.32 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.288 -0.634 . . . . 25.0 109.288 169.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.439 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 86.9 Cg_endo -76.1 -20.23 14.93 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 116.326 -1.983 . . . . 25.0 114.16 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -85.0 12.11 8.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.555 0.576 . . . . 25.0 112.555 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -68.79 -12.13 61.15 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.859 0.361 . . . . 25.0 111.966 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.09 133.65 29.52 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.877 0.846 . . . . 25.0 112.734 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -152.85 153.93 34.08 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.882 -1.525 . . . . 25.0 106.882 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.53 -172.43 26.69 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 109.339 -1.504 . . . . 25.0 109.339 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.4 tp -124.28 151.49 44.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.848 0.824 . . . . 25.0 111.774 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -64.26 156.99 27.15 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.772 -1.196 . . . . 25.0 107.772 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.17 -2.68 3.25 Favored Glycine 0 C--O 1.223 -0.565 0 CA-C-N 114.517 -1.22 . . . . 25.0 113.028 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -75.76 138.89 69.89 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 121.407 -1.054 . . . . 25.0 110.522 -175.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -92.71 -15.76 16.73 Favored 'Cis proline' 0 CA--C 1.543 0.955 0 N-CA-C 115.609 1.35 . . . . 25.0 115.609 -6.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -71.05 -35.35 71.92 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.412 1.634 . . . . 25.0 115.412 -168.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.07 32.74 5.71 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.938 -1.875 . . . . 25.0 105.938 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.21 -174.28 40.57 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 114.407 -1.27 . . . . 25.0 111.496 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.98 170.87 4.28 Favored 'Trans proline' 0 C--O 1.241 0.637 0 C-N-CA 123.212 2.608 . . . . 25.0 113.359 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.13 159.96 31.03 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.2 -1.407 . . . . 25.0 107.2 174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.86 139.19 58.04 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.424 -1.262 . . . . 25.0 107.96 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.39 -5.66 76.34 Favored Glycine 0 C--O 1.23 -0.12 0 CA-C-O 121.704 0.613 . . . . 25.0 112.874 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 20.3 m170 -126.43 9.21 7.18 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 71.4 mt -65.96 -49.7 74.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.276 -0.265 . . . . 25.0 111.161 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.17 -21.26 58.89 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.842 -0.536 . . . . 25.0 109.774 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -83.4 -6.58 59.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.758 0.651 . . . . 25.0 112.758 -178.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.78 32.6 12.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.544 0.738 . . . . 25.0 110.209 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.45 35.78 22.97 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.636 1.347 . . . . 25.0 114.636 -177.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -120.56 141.19 50.51 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.999 0.52 . . . . 25.0 111.743 176.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -65.35 -35.27 80.47 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.0 -6.85 45.13 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.348 0.594 . . . . 25.0 112.353 -177.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -120.45 12.66 11.66 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 107.226 -1.398 . . . . 25.0 107.226 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -71.77 -36.02 70.23 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.893 -1.129 . . . . 25.0 110.112 -175.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -71.38 -14.47 62.18 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.834 0.826 . . . . 25.0 109.967 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.9 mp -87.48 -7.59 57.44 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.405 -0.961 . . . . 25.0 108.405 -178.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -112.35 -31.99 6.65 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 120.959 0.409 . . . . 25.0 112.006 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -94.94 122.1 37.23 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 121.66 -0.65 . . . . 25.0 109.898 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.446 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -130.0 160.97 32.02 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.423 -0.955 . . . . 25.0 108.423 177.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.4 p -117.05 163.6 22.32 Favored Pre-proline 0 C--N 1.32 -0.71 1 N-CA-C 99.778 -4.156 . . . . 25.0 99.778 162.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -2.29 9.46 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 116.473 -1.885 . . . . 25.0 115.936 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.4 t -128.03 11.1 6.5 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.512 0.673 . . . . 25.0 111.831 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -79.12 -29.19 43.05 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.179 -0.951 . . . . 25.0 113.549 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.446 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.2 m95 -125.71 166.88 15.97 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.957 -0.386 . . . . 25.0 109.957 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -66.55 118.58 10.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.842 -1.54 . . . . 25.0 106.842 172.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -92.4 103.65 16.06 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 100.624 -3.843 . . . . 25.0 100.624 176.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.18 135.03 53.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.8 -1.091 . . . . 25.0 110.195 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -92.88 99.96 12.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.562 -1.199 . . . . 25.0 107.799 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.8 mt -131.7 173.95 10.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.558 -1.645 . . . . 25.0 106.558 -175.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -114.79 163.22 15.81 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.929 1.085 . . . . 25.0 113.929 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 74.5 p -76.96 168.58 19.86 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.71 -161.14 24.7 Favored Glycine 0 C--O 1.24 0.514 0 N-CA-C 110.619 -0.993 . . . . 25.0 110.619 -178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.85 131.11 41.87 Favored 'Trans proline' 0 C--N 1.346 0.443 0 CA-C-N 119.1 1.45 . . . . 25.0 114.437 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -140.07 159.71 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.816 -1.55 . . . . 25.0 106.816 178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 p -105.84 150.9 25.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.751 -1.204 . . . . 25.0 107.751 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -137.34 100.89 4.37 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 105.083 -2.191 . . . . 25.0 105.083 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.03 116.83 32.73 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.909 0.862 . . . . 25.0 109.811 -176.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -103.26 150.54 23.63 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.635 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -127.76 115.41 18.64 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 103.964 -2.606 . . . . 25.0 103.964 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -116.04 124.38 50.31 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.009 0.744 . . . . 25.0 113.009 -172.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.1 t -88.23 -1.93 58.3 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.05 0.452 . . . . 25.0 110.59 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.16 119.97 37.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.4 mmm180 -84.3 -0.13 51.28 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.925 1.454 . . . . 25.0 114.925 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.13 155.39 39.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 117.741 0.246 . . . . 25.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.6 t -74.14 155.95 37.87 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 114.879 1.437 . . . . 25.0 114.879 -171.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.406 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 7.3 t -90.73 162.61 14.82 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.01 -0.995 . . . . 25.0 108.552 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -117.89 -14.52 10.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.922 -0.769 . . . . 25.0 108.922 168.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 t -175.2 154.41 1.75 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.006 0.431 . . . . 25.0 111.213 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.1 m95 -116.99 130.65 56.83 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.861 -2.644 . . . . 25.0 103.861 165.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 53.0 mtt-85 -133.59 147.46 51.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.953 -1.128 . . . . 25.0 107.953 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -137.37 132.24 33.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 106.627 -1.62 . . . . 25.0 106.627 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.99 164.86 33.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.368 0.531 . . . . 25.0 110.69 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 167.99 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 113.249 0.833 . . . . 25.0 113.249 -167.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.3 p -83.76 161.5 20.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.879 -1.156 . . . . 25.0 107.879 168.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -61.88 158.19 44.92 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.159 -0.928 . . . . 25.0 109.796 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.79 -18.34 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 117.557 -1.162 . . . . 25.0 114.739 -173.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -120.84 31.71 6.29 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.166 0.432 . . . . 25.0 112.166 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -76.34 165.17 25.23 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.653 0.74 . . . . 25.0 110.889 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -87.54 101.02 13.22 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.167 -0.924 . . . . 25.0 110.272 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -79.09 18.54 0.64 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 115.749 1.759 . . . . 25.0 115.749 -174.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -117.77 -2.46 11.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.328 -0.619 . . . . 25.0 109.328 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -101.67 157.4 33.75 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.367 -0.833 . . . . 25.0 108.91 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -66.63 157.66 59.77 Favored 'Trans proline' 0 C--N 1.346 0.441 0 O-C-N 121.94 0.442 . . . . 25.0 112.233 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.64 105.45 4.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.507 0.67 . . . . 25.0 111.174 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 68.3 p -99.34 157.07 16.66 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.008 -0.738 . . . . 25.0 109.008 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -65.95 -26.13 67.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.139 0.495 . . . . 25.0 110.873 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.96 -24.99 60.86 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.506 -0.77 . . . . 25.0 112.239 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.1 t -83.44 -11.1 57.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.985 0.421 . . . . 25.0 111.54 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -94.18 156.71 16.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.715 1.006 . . . . 25.0 113.715 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -97.21 96.12 8.21 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 102.826 -3.027 . . . . 25.0 102.826 162.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.37 -7.54 32.24 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.711 1.004 . . . . 25.0 113.711 -171.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.76 122.7 78.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 108.124 -1.065 . . . . 25.0 108.124 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.91 139.79 36.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.362 -2.625 . . . . 25.0 111.996 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -87.7 -15.56 36.77 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.392 0.516 . . . . 25.0 112.392 -175.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.5 m -149.31 66.68 1.02 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.427 -0.351 . . . . 25.0 110.668 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -89.09 139.23 30.68 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 118.426 -1.31 . . . . 25.0 109.336 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -118.19 100.93 7.84 Favored 'General case' 0 CA--C 1.496 -1.113 0 N-CA-C 101.225 -3.62 . . . . 25.0 101.225 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -88.56 92.12 9.07 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 105.571 -2.011 . . . . 25.0 105.571 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.83 117.64 33.36 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.736 -1.579 . . . . 25.0 106.736 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.97 81.12 0.51 Allowed Glycine 0 CA--C 1.5 -0.855 0 CA-C-N 115.441 -0.8 . . . . 25.0 111.798 -173.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.21 16.85 5.54 Favored Glycine 0 C--N 1.32 -0.33 0 C-N-CA 120.86 -0.686 . . . . 25.0 114.283 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.87 104.18 5.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.629 -0.878 . . . . 25.0 108.629 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -75.84 127.56 85.24 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 107.54 -1.281 . . . . 25.0 107.54 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.44 153.77 60.79 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 117.985 -0.877 . . . . 25.0 113.842 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -98.8 30.88 3.14 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.982 -1.488 . . . . 25.0 106.982 177.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 72.74 -18.8 0.33 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.041 1.737 . . . . 25.0 111.705 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.426 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.5 mt-30 -129.23 151.51 49.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 104.941 -2.244 . . . . 25.0 104.941 171.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 47.6 t -144.08 95.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.495 -1.298 . . . . 25.0 107.495 -178.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -91.42 133.7 35.25 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 163.22 31.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 104.975 -2.231 . . . . 25.0 104.975 177.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -136.93 149.62 47.71 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 105.341 -2.096 . . . . 25.0 105.341 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 163.95 31.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.668 -1.234 . . . . 25.0 107.668 -178.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -102.01 118.78 37.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.439 0.162 . . . . 25.0 111.125 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.4 mt -76.25 132.23 73.69 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -63.34 147.53 93.54 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-O 121.692 0.622 . . . . 25.0 113.576 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.03 -26.15 43.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.25 -0.886 . . . . 25.0 112.769 -169.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -82.09 7.24 13.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.602 0.715 . . . . 25.0 110.113 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -114.44 52.29 0.84 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 107.812 -1.181 . . . . 25.0 107.812 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.92 11.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.041 -1.836 . . . . 25.0 106.041 173.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.68 -168.65 41.94 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 116.116 1.206 . . . . 25.0 116.116 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.15 109.14 18.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.45 0.643 . . . . 25.0 110.881 -169.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . 0.425 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.8 p-80 -158.24 171.32 20.41 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.91 -0.586 . . . . 25.0 111.406 -176.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.7 p -102.92 150.2 6.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 107.315 -1.365 . . . . 25.0 107.315 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.1 mt -133.21 127.81 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 102.201 -3.259 . . . . 25.0 102.201 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.0 mp -119.96 141.27 49.81 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.848 -0.614 . . . . 25.0 109.657 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.59 140.43 52.12 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.987 -0.745 . . . . 25.0 108.987 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -127.32 135.84 62.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.059 0.933 . . . . 25.0 112.325 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.406 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.7 t90 -95.11 111.43 23.25 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.876 -2.268 . . . . 25.0 104.876 170.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -98.16 119.33 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 -177.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.6 mm -86.44 141.35 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -170.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -83.52 -46.53 12.34 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.348 0.594 . . . . 25.0 110.848 175.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.16 -27.05 66.09 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.788 1.403 . . . . 25.0 114.788 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.2 p -138.06 164.29 29.47 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.172 -0.677 . . . . 25.0 109.172 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -77.85 26.79 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.621 0.971 . . . . 25.0 113.621 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -96.05 148.96 22.12 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.574 -0.704 . . . . 25.0 112.59 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.41 138.24 9.73 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 106.373 -1.714 . . . . 25.0 106.373 170.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -146.86 131.45 17.79 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.242 0.474 . . . . 25.0 112.204 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -91.18 118.01 30.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.156 -0.475 . . . . 25.0 111.449 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -96.99 113.92 25.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.423 -0.954 . . . . 25.0 108.423 178.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.47 142.95 27.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.746 -0.661 . . . . 25.0 112.713 -175.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.47 136.77 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.032 -2.21 . . . . 25.0 105.032 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -97.17 131.58 43.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.68 162.83 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 113.049 0.759 . . . . 25.0 113.049 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -120.06 95.07 4.6 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 167.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.86 161.09 15.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.158 0.799 . . . . 25.0 113.158 -171.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 66.0 p -145.85 166.45 25.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.83 -0.804 . . . . 25.0 108.83 175.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.755 0 CA-C-O 118.827 -0.606 . . . . 25.0 110.408 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.6 m80 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.471 0.653 . . . . 25.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.5 170.87 38.9 Favored Glycine 0 CA--C 1.509 -0.307 1 N-CA-C 101.282 -4.727 . . . . 25.0 101.282 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -141.72 154.92 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 120.144 1.972 . . . . 25.0 109.787 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.31 119.61 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 106.019 -1.845 . . . . 25.0 106.019 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.32 -44.61 36.05 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.314 -1.312 . . . . 25.0 110.338 -172.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -148.46 124.55 5.27 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -64.65 131.4 12.08 Favored 'Cis proline' 0 CA--C 1.536 0.617 0 C-N-CA 128.7 0.708 . . . . 25.0 111.766 -0.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.84 112.51 4.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -173.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 t -71.98 158.42 36.03 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.576 -0.528 . . . . 25.0 109.576 -178.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -55.33 -25.43 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.714 0.806 . . . . 25.0 112.08 178.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.33 -51.47 52.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.64 0.733 . . . . 25.0 109.296 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.13 -37.03 84.7 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.719 -0.673 . . . . 25.0 109.977 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.7 -32.46 73.56 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 122.344 -0.223 . . . . 25.0 110.97 178.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -40.82 96.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.559 . . . . 25.0 110.323 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.407 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.6 tmtm? -68.15 -34.44 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.27 0.557 . . . . 25.0 109.812 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.7 mt -78.0 6.58 7.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.043 -0.526 . . . . 25.0 111.681 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 59.15 23.19 11.43 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.218 1.407 . . . . 25.0 113.342 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.482 ' C ' HD21 ' A' ' 19' ' ' ASN . 90.2 mt -90.09 -21.08 22.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.491 -0.929 . . . . 25.0 108.491 174.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.482 HD21 ' C ' ' A' ' 18' ' ' LEU . 1.8 m120 -123.54 159.97 28.01 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 106.097 -1.816 . . . . 25.0 106.097 178.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 p -135.69 174.59 10.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.566 0.347 . . . . 25.0 111.126 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 66.93 4.99 3.78 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 116.855 2.169 . . . . 25.0 116.855 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -64.89 -38.99 92.83 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 121.664 -0.648 . . . . 25.0 111.261 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.57 1.58 Allowed Glycine 0 C--O 1.217 -0.948 0 O-C-N 123.733 0.646 . . . . 25.0 111.92 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 t -88.07 -52.27 5.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.574 1.178 . . . . 25.0 110.994 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -7.13 7.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.33 -1.305 . . . . 25.0 113.53 -171.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -90.74 -0.74 57.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.851 -0.531 . . . . 25.0 111.302 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -116.39 -34.02 4.75 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.259 -0.577 . . . . 25.0 109.748 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.94 102.44 24.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.461 -0.57 . . . . 25.0 109.461 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 92.6 Cg_endo -74.37 -20.54 18.34 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 117.383 -1.278 . . . . 25.0 113.955 -174.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -87.03 14.96 6.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.432 0.53 . . . . 25.0 112.432 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 61.5 m -65.09 -21.33 66.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.989 0.424 . . . . 25.0 111.651 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.67 125.96 22.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 115.274 1.583 . . . . 25.0 115.274 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -152.93 159.77 42.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.127 -1.805 . . . . 25.0 106.127 172.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.01 -167.47 21.51 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 107.661 -2.176 . . . . 25.0 107.661 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -119.33 150.67 39.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 118.31 1.055 . . . . 25.0 111.916 -177.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -65.29 152.85 42.74 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.089 -1.448 . . . . 25.0 107.089 172.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.14 2.07 1.65 Allowed Glycine 0 C--N 1.317 -0.498 0 CA-C-N 115.091 -0.958 . . . . 25.0 114.153 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -75.97 140.64 70.5 Favored Pre-proline 0 C--N 1.322 -0.619 0 O-C-N 121.605 -0.938 . . . . 25.0 109.369 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -93.23 -13.45 20.46 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 C-N-CA 130.473 1.447 . . . . 25.0 115.607 -6.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.84 -37.42 76.17 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.489 1.292 . . . . 25.0 114.489 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.48 30.5 7.26 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.57 -179.93 44.83 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 114.384 -1.28 . . . . 25.0 110.79 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -62.54 173.35 3.6 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.985 2.457 . . . . 25.0 113.356 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 160.04 31.05 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 107.207 -1.405 . . . . 25.0 107.207 173.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -60.66 139.69 57.75 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 107.204 -1.406 . . . . 25.0 107.204 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.51 -5.89 79.35 Favored Glycine 0 CA--C 1.511 -0.184 0 CA-C-N 116.232 -0.44 . . . . 25.0 112.628 -174.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -124.97 8.86 8.08 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.517 -0.402 . . . . 25.0 109.954 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.32 -49.48 80.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 122.047 -0.408 . . . . 25.0 111.502 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.33 -16.96 59.64 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.992 -0.442 . . . . 25.0 110.102 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.7 p -87.28 -7.56 57.71 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.02 30.89 10.14 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.521 0.729 . . . . 25.0 110.464 -172.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.97 37.25 24.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.357 1.243 . . . . 25.0 114.357 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.2 135.71 54.89 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.938 0.495 . . . . 25.0 110.807 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 p -61.44 -34.78 76.0 Favored 'General case' 0 C--O 1.213 -0.827 0 N-CA-C 114.627 1.343 . . . . 25.0 114.627 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -69.2 -8.56 46.86 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -178.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -122.68 12.48 9.92 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 108.123 -1.065 . . . . 25.0 108.123 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -70.71 -39.58 73.36 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.901 -1.125 . . . . 25.0 111.176 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -73.38 -11.06 60.35 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.697 0.761 . . . . 25.0 109.423 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mp -88.14 -3.09 58.93 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.768 -0.826 . . . . 25.0 108.768 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -114.11 -34.02 5.5 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.973 0.416 . . . . 25.0 111.357 172.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -86.6 116.1 24.5 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 121.78 -0.575 . . . . 25.0 110.375 -178.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.462 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.8 pm0 -125.46 160.9 28.31 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.401 0.619 . . . . 25.0 110.658 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.1 p -119.88 160.22 43.56 Favored Pre-proline 0 C--N 1.317 -0.816 1 N-CA-C 99.719 -4.178 . . . . 25.0 99.719 160.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.17 -2.63 10.79 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 N-CA-C 116.094 1.536 . . . . 25.0 116.094 -173.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -121.21 9.76 10.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.182 0.515 . . . . 25.0 111.361 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -79.65 -28.66 40.84 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.243 0.831 . . . . 25.0 113.243 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.2 m95 -126.6 168.35 14.43 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.773 0.321 . . . . 25.0 111.259 -176.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -69.6 119.38 13.75 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 106.75 -1.574 . . . . 25.0 106.75 171.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.3 mmtt -93.29 103.08 15.35 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 101.183 -3.636 . . . . 25.0 101.183 177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.79 135.58 55.07 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.917 -1.038 . . . . 25.0 110.621 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -89.69 102.41 15.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.177 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.6 173.85 10.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.577 -1.268 . . . . 25.0 107.577 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.16 157.36 24.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.937 -0.574 . . . . 25.0 111.243 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.4 p -76.96 168.83 19.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 106.877 -1.527 . . . . 25.0 106.877 171.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.93 -160.93 26.56 Favored Glycine 0 C--O 1.239 0.468 0 N-CA-C 110.424 -1.071 . . . . 25.0 110.424 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.95 131.51 42.16 Favored 'Trans proline' 0 C--N 1.347 0.449 0 CA-C-N 119.061 1.43 . . . . 25.0 114.177 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -137.91 161.94 35.34 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 106.7 -1.592 . . . . 25.0 106.7 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.8 p -103.39 149.49 24.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.392 -1.336 . . . . 25.0 107.392 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -137.57 101.06 4.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.042 -2.207 . . . . 25.0 105.042 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.8 113.99 27.87 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.224 1.011 . . . . 25.0 110.046 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -95.48 146.94 24.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.028 -0.987 . . . . 25.0 108.697 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -124.97 114.45 19.15 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 103.655 -2.72 . . . . 25.0 103.655 179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.12 138.51 48.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.477 -0.783 . . . . 25.0 110.037 -173.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.0 t -101.0 14.53 31.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.241 1.02 . . . . 25.0 109.136 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.5 134.85 29.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.899 -0.591 . . . . 25.0 110.079 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -90.1 5.65 45.87 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.588 0.588 . . . . 25.0 112.588 -179.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.79 153.25 42.38 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.904 -0.406 . . . . 25.0 109.904 178.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 t -74.36 156.07 37.47 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.264 1.209 . . . . 25.0 114.264 -170.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -102.93 157.42 16.99 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -118.01 -14.93 9.97 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 111.541 0.2 . . . . 25.0 111.541 173.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.5 t -172.45 154.26 3.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.975 0.417 . . . . 25.0 111.897 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -126.63 139.05 53.47 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 104.3 -2.481 . . . . 25.0 104.3 167.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 16.8 mtt-85 -144.9 150.61 37.34 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.446 -0.946 . . . . 25.0 108.446 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -137.69 136.22 37.2 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.333 -1.728 . . . . 25.0 106.333 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -148.52 162.43 39.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.515 0.598 . . . . 25.0 110.022 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.99 166.0 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 113.478 0.918 . . . . 25.0 113.478 -167.197 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -80.98 162.39 23.86 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.688 -1.227 . . . . 25.0 107.688 169.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -62.39 158.39 48.58 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.31 -0.859 . . . . 25.0 108.994 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.03 -23.33 34.25 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 116.565 -1.823 . . . . 25.0 114.272 -173.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -113.87 32.06 6.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.576 0.351 . . . . 25.0 111.499 -175.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.51 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.4 p-90 -76.14 164.31 26.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.98 0.895 . . . . 25.0 112.541 -176.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -83.04 100.93 10.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.523 -1.217 . . . . 25.0 110.101 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.09 12.88 10.43 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.662 2.097 . . . . 25.0 116.662 -170.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.7 t -121.08 7.91 10.35 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.561 -0.903 . . . . 25.0 108.561 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.22 159.52 32.51 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 107.388 -1.338 . . . . 25.0 107.388 -174.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 158.04 57.04 Favored 'Trans proline' 0 C--N 1.346 0.435 0 O-C-N 121.894 0.418 . . . . 25.0 113.08 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.59 106.32 3.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.898 0.38 . . . . 25.0 110.522 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -103.42 153.66 20.26 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.808 -0.812 . . . . 25.0 108.808 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -64.69 -25.14 67.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.0 0.429 . . . . 25.0 111.484 177.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.12 64.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.623 -0.717 . . . . 25.0 112.221 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.1 t -80.66 -21.06 41.74 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.632 0.73 . . . . 25.0 110.983 -178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -86.56 152.1 22.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 115.2 1.555 . . . . 25.0 115.2 -176.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -95.67 92.82 6.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 102.692 -3.077 . . . . 25.0 102.692 163.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.42 -6.25 13.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -170.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -84.93 131.68 48.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.66 140.91 27.07 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 115.779 -2.347 . . . . 25.0 112.369 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -92.16 -11.87 34.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.382 0.512 . . . . 25.0 112.382 -177.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.4 m -148.98 66.75 1.04 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.503 0.321 . . . . 25.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -88.99 133.52 34.3 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 118.357 -1.337 . . . . 25.0 109.027 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -118.89 99.08 6.52 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 102.715 -3.069 . . . . 25.0 102.715 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -91.53 91.95 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.446 -1.687 . . . . 25.0 106.446 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -110.45 117.28 33.15 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.808 -1.182 . . . . 25.0 107.808 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.01 78.67 0.87 Allowed Glycine 0 CA--C 1.502 -0.772 0 CA-C-N 115.072 -0.967 . . . . 25.0 113.787 -169.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.59 22.21 6.82 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 121.015 -0.612 . . . . 25.0 113.906 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.67 106.71 4.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.802 0.811 . . . . 25.0 109.284 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.32 122.87 88.3 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.975 -1.121 . . . . 25.0 107.975 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -77.92 168.36 22.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 N-CA-C 114.633 0.974 . . . . 25.0 114.633 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.403 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -109.21 33.26 4.38 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.83 -18.36 0.31 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.823 1.649 . . . . 25.0 112.76 -177.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.403 ' H ' ' C ' ' A' ' 128' ' ' ALA . 64.0 mt-30 -128.58 152.8 47.91 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 104.823 -2.288 . . . . 25.0 104.823 168.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -140.49 95.02 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.0 m -94.85 122.75 37.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.109 -1.441 . . . . 25.0 107.109 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.69 167.05 19.44 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 105.73 -1.952 . . . . 25.0 105.73 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -130.31 151.0 51.29 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.256 -2.128 . . . . 25.0 105.256 175.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 160.5 38.4 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.219 -1.401 . . . . 25.0 107.219 -177.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -103.28 115.8 31.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.091 0.245 . . . . 25.0 111.072 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.29 132.45 73.14 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 107.508 -1.293 . . . . 25.0 107.508 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.47 146.74 96.79 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-O 121.699 0.625 . . . . 25.0 113.519 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.91 37.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.219 -0.9 . . . . 25.0 112.658 -168.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -85.46 10.42 12.97 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.622 0.725 . . . . 25.0 110.103 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -116.53 53.53 0.88 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 171.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -85.99 170.97 11.8 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 84.95 -168.3 42.98 Favored Glycine 0 C--N 1.321 -0.295 0 N-CA-C 116.157 1.223 . . . . 25.0 116.157 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.5 t -85.9 108.87 18.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 25.0 111.097 -168.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -157.46 171.38 20.48 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.993 -0.548 . . . . 25.0 111.388 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.42 151.04 7.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 107.963 -1.125 . . . . 25.0 107.963 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -133.79 122.45 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -106.54 133.39 51.3 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.71 -0.677 . . . . 25.0 109.921 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.24 135.32 53.33 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 122.939 0.495 . . . . 25.0 110.227 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.96 145.87 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 122.13 0.967 . . . . 25.0 112.901 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -113.63 112.95 24.36 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.929 -1.878 . . . . 25.0 105.929 172.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.3 122.27 35.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.707 -1.22 . . . . 25.0 107.707 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 15.5 mm -79.14 141.72 14.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.153 -0.684 . . . . 25.0 109.153 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.32 -42.34 23.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.75 0.704 . . . . 25.0 109.845 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.88 -23.87 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.75 1.018 . . . . 25.0 113.75 -172.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 49.0 p -138.8 169.65 17.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.867 0.841 . . . . 25.0 110.149 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.92 19.01 0.91 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.308 -0.86 . . . . 25.0 112.356 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.05 146.17 24.53 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.26 0.837 . . . . 25.0 113.26 -175.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.65 143.19 11.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 105.291 -2.114 . . . . 25.0 105.291 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -148.06 128.35 13.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 111.632 0.234 . . . . 25.0 111.632 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -86.82 118.34 26.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.032 0.444 . . . . 25.0 110.679 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -96.99 115.44 27.43 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.258 -1.016 . . . . 25.0 108.258 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.7 142.38 29.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.131 -0.486 . . . . 25.0 111.921 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -127.15 136.22 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 105.1 -2.185 . . . . 25.0 105.1 166.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -97.02 130.63 44.31 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.054 -1.461 . . . . 25.0 107.054 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.17 162.5 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 113.101 0.778 . . . . 25.0 113.101 -174.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.67 94.99 4.66 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 104.382 -2.451 . . . . 25.0 104.382 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.54 163.76 14.48 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.4 p -145.9 164.09 33.08 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.954 -1.128 . . . . 25.0 107.954 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.42 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-O 117.74 -1.124 . . . . 25.0 111.536 -177.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 121.086 0.469 . . . . 25.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.67 170.88 22.99 Favored Glycine 0 CA--C 1.509 -0.342 1 N-CA-C 101.652 -4.579 . . . . 25.0 101.652 -175.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -146.62 163.16 36.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 120.297 2.049 . . . . 25.0 110.687 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -97.86 121.87 48.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -41.79 53.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.624 -1.171 . . . . 25.0 109.863 -174.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.64 129.3 5.17 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 106.018 -1.845 . . . . 25.0 106.018 176.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -64.46 132.25 13.62 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 128.751 0.73 . . . . 25.0 111.093 -0.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.78 112.61 4.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.038 -0.528 . . . . 25.0 111.855 -172.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.8 t -71.93 158.34 36.2 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 108.185 -1.043 . . . . 25.0 108.185 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -55.57 -24.77 34.49 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.304 0.642 . . . . 25.0 112.049 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.17 -53.78 33.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.819 0.819 . . . . 25.0 109.43 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -67.65 -35.09 78.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.505 -0.77 . . . . 25.0 110.564 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.68 -33.0 74.66 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.111 -0.368 . . . . 25.0 110.734 178.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -40.79 98.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.347 0.594 . . . . 25.0 109.555 177.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -67.85 -35.03 77.85 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.215 0.531 . . . . 25.0 110.185 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.69 5.47 9.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 25.0 111.436 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 59.1 24.95 13.32 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.097 1.359 . . . . 25.0 112.78 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.451 ' C ' HD21 ' A' ' 19' ' ' ASN . 89.1 mt -91.14 -21.84 20.98 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.131 -1.063 . . . . 25.0 108.131 174.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.451 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -124.06 159.9 28.88 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.011 -1.848 . . . . 25.0 106.011 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.2 p -134.73 175.49 9.5 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 122.261 0.225 . . . . 25.0 110.508 -176.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 70.21 5.08 5.15 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.574 1.694 . . . . 25.0 115.574 175.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.9 m -66.66 -38.49 86.95 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 121.412 -0.805 . . . . 25.0 110.565 172.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.63 -63.94 1.48 Allowed Glycine 0 C--O 1.218 -0.861 0 O-C-N 123.754 0.659 . . . . 25.0 112.114 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.3 t -88.06 -52.82 5.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.423 1.106 . . . . 25.0 111.098 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.64 -9.97 12.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.697 -1.138 . . . . 25.0 113.54 -171.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.97 -3.06 58.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.857 -0.527 . . . . 25.0 111.266 177.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -116.25 -34.02 4.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.456 -0.572 . . . . 25.0 109.456 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -126.9 97.67 32.24 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 109.989 -0.375 . . . . 25.0 109.989 173.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -74.97 -20.73 16.65 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 118.041 -0.839 . . . . 25.0 113.956 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -84.14 11.01 8.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.471 0.545 . . . . 25.0 112.471 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.7 m -64.83 -22.57 67.02 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.448 0.536 . . . . 25.0 112.448 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.1 m -64.04 121.42 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 115.12 1.526 . . . . 25.0 115.12 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -152.82 158.54 42.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 106.517 -1.66 . . . . 25.0 106.517 174.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.47 -166.18 18.76 Favored Glycine 0 N--CA 1.453 -0.209 0 N-CA-C 108.094 -2.003 . . . . 25.0 108.094 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -120.02 148.67 43.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.382 1.091 . . . . 25.0 112.079 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.39 157.0 33.0 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 171.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.25 2.02 1.64 Allowed Glycine 0 C--O 1.224 -0.493 0 CA-C-N 114.802 -1.09 . . . . 25.0 113.766 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -75.94 139.31 69.47 Favored Pre-proline 0 C--N 1.322 -0.622 0 O-C-N 121.576 -0.955 . . . . 25.0 110.067 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -93.45 -14.8 17.08 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 C-N-CA 130.35 1.396 . . . . 25.0 115.613 -6.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -70.98 -35.82 72.27 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.936 1.458 . . . . 25.0 114.936 -168.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -121.39 31.63 6.24 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 105.553 -2.018 . . . . 25.0 105.553 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.48 -177.61 41.45 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 114.389 -1.278 . . . . 25.0 111.749 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.3 172.5 3.26 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 123.505 2.803 . . . . 25.0 113.498 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 160.01 31.03 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.141 -1.429 . . . . 25.0 107.141 173.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -61.21 139.13 58.19 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.249 -1.389 . . . . 25.0 107.249 175.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.06 86.37 Favored Glycine 0 C--O 1.228 -0.275 0 CA-C-N 116.079 -0.51 . . . . 25.0 112.593 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -125.58 9.58 7.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.906 -0.775 . . . . 25.0 108.906 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.38 -49.51 74.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 122.132 -0.355 . . . . 25.0 111.631 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.1 -25.39 59.77 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.637 -0.505 . . . . 25.0 109.637 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.4 p -79.85 -9.77 59.7 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.181 0.437 . . . . 25.0 112.181 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.37 34.4 14.93 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.857 0.863 . . . . 25.0 109.984 -172.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.23 39.26 25.95 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.951 1.463 . . . . 25.0 114.951 -177.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -120.16 134.63 55.21 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.992 0.517 . . . . 25.0 110.614 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -61.68 -35.76 78.9 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 115.368 1.618 . . . . 25.0 115.368 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.03 -7.18 44.6 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.308 0.575 . . . . 25.0 112.456 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 59' ' ' LEU . 12.7 m-85 -121.74 13.47 10.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -72.14 -37.29 69.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.192 -0.942 . . . . 25.0 110.841 -175.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.7 mp0 -69.81 -17.02 63.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.85 0.833 . . . . 25.0 109.802 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.26 -5.47 59.32 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.902 -0.777 . . . . 25.0 108.902 -177.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.55 -32.82 6.34 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.561 0.578 . . . . 25.0 112.561 173.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -97.61 119.49 36.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 O-C-N 121.458 -0.776 . . . . 25.0 110.629 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.48 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -123.92 160.95 26.39 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.383 -0.826 . . . . 25.0 109.596 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -117.29 162.48 27.91 Favored Pre-proline 0 C--N 1.317 -0.824 1 N-CA-C 99.908 -4.108 . . . . 25.0 99.908 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.33 -5.34 15.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 116.559 -1.828 . . . . 25.0 115.763 -174.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.25 10.38 9.29 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.177 0.513 . . . . 25.0 111.77 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -78.8 -28.77 44.62 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.042 0.756 . . . . 25.0 113.042 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.48 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.1 m95 -126.94 165.41 19.46 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 120.787 0.327 . . . . 25.0 110.463 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.58 131.41 45.95 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 105.959 -1.867 . . . . 25.0 105.959 170.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -101.2 106.85 18.11 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 101.06 -3.681 . . . . 25.0 101.06 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.21 136.18 51.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.952 -1.022 . . . . 25.0 110.329 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -90.23 104.04 16.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.802 -1.09 . . . . 25.0 108.478 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.3 mt -129.92 173.91 10.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.542 -1.281 . . . . 25.0 107.542 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.59 157.64 24.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.768 -0.651 . . . . 25.0 111.472 -174.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 69.6 p -77.04 169.52 18.18 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.154 -1.425 . . . . 25.0 107.154 172.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.2 -161.69 27.93 Favored Glycine 0 C--O 1.239 0.413 0 N-CA-C 110.702 -0.959 . . . . 25.0 110.702 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.88 132.2 46.28 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 119.012 1.406 . . . . 25.0 113.964 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -137.26 160.88 37.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.289 -1.745 . . . . 25.0 106.289 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.5 p -104.84 152.03 23.09 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.53 -1.285 . . . . 25.0 107.53 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -139.15 101.06 4.18 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.37 -2.085 . . . . 25.0 105.37 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.1 113.45 26.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.977 0.894 . . . . 25.0 109.924 -178.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -99.59 145.13 27.88 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.184 -0.917 . . . . 25.0 110.055 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -123.19 108.91 13.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.968 -2.234 . . . . 25.0 104.968 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -104.83 135.46 46.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.601 -0.727 . . . . 25.0 109.86 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.7 t -101.28 17.67 21.96 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.723 0.773 . . . . 25.0 109.95 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.29 141.35 33.94 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.992 -0.744 . . . . 25.0 108.992 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -85.29 -4.85 59.3 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.662 0.615 . . . . 25.0 112.662 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.85 155.13 31.51 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.564 0.579 . . . . 25.0 112.564 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -74.39 155.83 37.68 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -173.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.443 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 9.8 t -99.09 157.94 16.0 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.013 -1.106 . . . . 25.0 108.013 173.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -117.75 -16.62 10.0 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.738 0.273 . . . . 25.0 111.738 172.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 t -171.91 152.44 2.99 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.869 0.366 . . . . 25.0 111.886 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -124.95 139.63 53.65 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.389 -2.449 . . . . 25.0 104.389 167.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -144.56 148.67 34.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.128 -1.064 . . . . 25.0 108.128 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.95 134.69 35.24 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.64 161.37 42.31 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.364 0.529 . . . . 25.0 110.187 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 163.15 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.52 0.933 . . . . 25.0 113.52 -167.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 p -77.46 161.15 28.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.811 -1.181 . . . . 25.0 107.811 171.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -61.44 157.24 47.28 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.044 -0.98 . . . . 25.0 109.16 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.89 -23.6 34.75 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.95 -1.566 . . . . 25.0 114.13 -172.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -113.36 32.01 6.07 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 122.621 0.368 . . . . 25.0 111.544 -174.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.513 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -78.7 163.68 25.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.838 0.827 . . . . 25.0 111.587 -177.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -87.86 100.98 13.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.844 -1.071 . . . . 25.0 110.393 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.513 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -78.85 21.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 116.158 1.91 . . . . 25.0 116.158 -173.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -120.74 -0.78 10.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.37 0.605 . . . . 25.0 109.826 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -101.64 156.49 35.13 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.376 -0.829 . . . . 25.0 108.806 -176.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.39 158.27 57.84 Favored 'Trans proline' 0 C--N 1.346 0.437 0 O-C-N 121.882 0.411 . . . . 25.0 111.525 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.99 97.61 1.91 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.324 0.583 . . . . 25.0 112.105 -176.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.7 p -91.87 152.94 19.85 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.474 -0.935 . . . . 25.0 108.474 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -65.26 -25.48 67.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.246 0.546 . . . . 25.0 111.049 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.87 -27.1 66.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.419 -0.81 . . . . 25.0 112.295 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 t -84.65 -5.87 59.33 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.054 0.391 . . . . 25.0 112.054 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -100.7 154.21 18.8 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 114.105 1.15 . . . . 25.0 114.105 -175.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -94.59 93.92 7.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 102.633 -3.099 . . . . 25.0 102.633 163.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.34 -7.3 23.6 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -169.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.8 t -83.68 128.31 64.18 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 176.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.71 146.51 48.79 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 115.278 -2.682 . . . . 25.0 111.336 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -97.11 -10.23 26.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.979 0.419 . . . . 25.0 111.527 -177.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.3 m -148.97 67.25 1.04 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.57 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -88.98 132.33 34.77 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 118.967 -1.093 . . . . 25.0 108.79 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -124.41 98.98 5.98 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 104.738 -2.319 . . . . 25.0 104.738 177.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -92.55 92.16 7.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -103.74 117.61 34.78 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 107.278 -1.379 . . . . 25.0 107.278 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -97.71 78.35 0.63 Allowed Glycine 0 CA--C 1.504 -0.636 0 CA-C-N 115.447 -0.797 . . . . 25.0 114.021 -169.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 112.3 22.0 6.01 Favored Glycine 0 C--N 1.321 -0.28 0 C-N-CA 120.817 -0.706 . . . . 25.0 113.203 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.68 107.03 5.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.531 0.681 . . . . 25.0 109.363 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.06 123.0 88.61 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 106.036 -1.838 . . . . 25.0 106.036 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.91 171.6 17.69 Favored 'Trans proline' 0 C--N 1.345 0.343 0 N-CA-C 113.715 0.621 . . . . 25.0 113.715 -175.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.11 27.27 5.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.581 -0.896 . . . . 25.0 108.581 176.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.56 -17.77 0.27 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.716 1.607 . . . . 25.0 112.365 -174.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 128' ' ' ALA . 67.5 mt-30 -127.23 153.33 46.24 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 103.494 -2.78 . . . . 25.0 103.494 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 69.5 t -141.41 95.08 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.604 0 N-CA-C 106.263 -1.754 . . . . 25.0 106.263 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.5 t -85.96 143.79 27.98 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 103.557 -2.757 . . . . 25.0 103.557 172.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.04 167.0 29.86 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.933 -1.485 . . . . 25.0 107.59 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -134.67 156.05 49.44 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.654 -1.61 . . . . 25.0 106.654 174.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.6 160.34 25.71 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.098 -1.445 . . . . 25.0 107.098 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -104.75 116.96 32.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.054 0.222 . . . . 25.0 110.979 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.86 132.12 68.66 Favored Pre-proline 0 CA--C 1.54 0.576 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -61.96 147.94 94.14 Favored 'Trans proline' 0 C--N 1.352 0.716 0 CA-C-O 121.652 0.605 . . . . 25.0 113.474 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.57 -26.54 34.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.32 -0.855 . . . . 25.0 112.594 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -83.6 10.1 9.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.602 0.715 . . . . 25.0 110.305 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.3 mmt-85 -116.34 50.0 1.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.568 -0.901 . . . . 25.0 108.568 172.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 35.9 p -86.0 164.94 17.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.672 -1.603 . . . . 25.0 106.672 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.97 -167.94 31.0 Favored Glycine 0 N--CA 1.451 -0.339 0 N-CA-C 115.043 0.777 . . . . 25.0 115.043 177.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -85.99 111.03 19.89 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.369 0.604 . . . . 25.0 110.908 -168.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 48.5 p-80 -159.14 171.08 20.59 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 115.913 -0.585 . . . . 25.0 111.241 -176.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.0 p -104.75 150.5 7.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.6 mt -132.24 120.99 45.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.83 131.53 52.19 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.394 -0.821 . . . . 25.0 109.62 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -123.59 133.14 54.0 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.519 -0.549 . . . . 25.0 109.519 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.46 143.78 36.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 122.073 0.939 . . . . 25.0 112.356 -178.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.443 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.8 t90 -113.8 113.22 24.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.872 -1.899 . . . . 25.0 105.872 173.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.64 125.74 38.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.981 -1.118 . . . . 25.0 107.981 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.6 mm -80.71 142.1 14.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.901 -0.777 . . . . 25.0 108.901 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.53 -43.49 22.99 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 118.806 0.73 . . . . 25.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.2 -23.24 64.81 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.749 1.018 . . . . 25.0 113.749 -172.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.1 p -138.63 168.76 19.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.962 0.887 . . . . 25.0 110.022 -175.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.88 21.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.216 -0.902 . . . . 25.0 112.313 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -91.63 145.27 24.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.076 0.769 . . . . 25.0 113.076 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.55 143.58 13.29 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 105.106 -2.183 . . . . 25.0 105.106 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -148.55 129.77 14.62 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.137 0.421 . . . . 25.0 112.137 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -85.53 117.37 24.39 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 121.105 0.479 . . . . 25.0 111.063 177.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -97.12 108.19 20.87 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.318 -1.364 . . . . 25.0 107.318 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.16 142.76 30.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.829 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -126.9 136.1 61.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 105.424 -2.065 . . . . 25.0 105.424 168.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -97.02 129.11 44.52 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.51 163.07 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.157 0.799 . . . . 25.0 113.157 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -117.83 95.28 4.85 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 103.994 -2.595 . . . . 25.0 103.994 166.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.6 tp -89.94 163.04 15.12 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 120.909 0.385 . . . . 25.0 111.652 -172.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.0 p -145.85 158.03 43.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.413 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 118.113 -0.946 . . . . 25.0 111.368 -178.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.0 m170 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 110.599 -0.149 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.23 166.09 11.89 Favored Glycine 0 N--CA 1.459 0.217 1 N-CA-C 102.758 -4.137 . . . . 25.0 102.758 -174.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.2 p90 -149.38 168.12 24.27 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.444 2.122 . . . . 25.0 111.921 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -103.82 124.37 58.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.565 -1.272 . . . . 25.0 107.565 176.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.89 -43.18 30.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.922 -1.036 . . . . 25.0 109.968 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -152.89 129.8 5.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.923 -1.88 . . . . 25.0 105.923 176.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.76 130.79 9.84 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.933 0.806 . . . . 25.0 111.451 0.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.76 4.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.875 -0.602 . . . . 25.0 112.11 -172.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.7 t -72.14 157.34 37.93 Favored 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 108.667 -0.864 . . . . 25.0 108.667 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -55.2 -25.61 33.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.726 0.81 . . . . 25.0 111.924 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.26 30.21 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.824 0.821 . . . . 25.0 109.157 175.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -66.48 -35.74 81.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.498 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.3 -33.36 75.35 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 122.157 -0.34 . . . . 25.0 110.849 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -39.79 94.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.225 0.536 . . . . 25.0 109.862 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -68.21 -35.19 77.59 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.226 0.536 . . . . 25.0 110.034 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -77.77 4.4 11.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 25.0 111.278 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 58.95 22.39 10.29 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.175 1.39 . . . . 25.0 112.975 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.444 ' C ' HD21 ' A' ' 19' ' ' ASN . 92.8 mt -86.55 -21.69 26.76 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 174.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.444 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -123.75 158.81 30.84 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 105.435 -2.061 . . . . 25.0 105.435 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.3 p -135.81 176.95 8.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.439 -0.578 . . . . 25.0 109.439 -176.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 71.3 5.13 5.33 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.442 1.645 . . . . 25.0 115.442 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -68.76 -38.13 79.87 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 121.53 -0.732 . . . . 25.0 110.821 174.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.8 -63.62 1.55 Allowed Glycine 0 C--O 1.217 -0.924 0 O-C-N 123.713 0.633 . . . . 25.0 112.116 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.8 t -88.0 -53.31 4.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 122.503 1.144 . . . . 25.0 111.643 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.28 -11.11 13.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.563 -1.199 . . . . 25.0 113.239 -171.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -86.91 -2.71 58.81 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.751 -0.593 . . . . 25.0 111.479 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -116.25 -34.11 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.129 -0.628 . . . . 25.0 109.594 173.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -126.9 92.44 44.55 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 120.926 0.393 . . . . 25.0 111.463 171.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -74.15 -19.13 20.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 117.66 -1.093 . . . . 25.0 114.022 -176.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.99 5.38 41.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.231 0.456 . . . . 25.0 112.231 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -2.28 24.33 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.993 0.738 . . . . 25.0 112.993 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.432 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.3 m -64.08 138.03 23.76 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 N-CA-C 113.343 0.868 . . . . 25.0 113.343 -177.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -153.02 152.28 31.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.345 -0.843 . . . . 25.0 108.779 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.58 -176.35 33.58 Favored Glycine 0 N--CA 1.452 -0.256 0 N-CA-C 107.346 -2.302 . . . . 25.0 107.346 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.84 150.3 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 118.364 1.082 . . . . 25.0 111.758 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.52 156.98 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.602 -1.258 . . . . 25.0 107.602 172.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.82 -1.74 3.57 Favored Glycine 0 C--O 1.224 -0.504 0 CA-C-N 114.756 -1.111 . . . . 25.0 112.797 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -75.98 142.1 72.22 Favored Pre-proline 0 C--N 1.322 -0.617 0 O-C-N 121.546 -0.973 . . . . 25.0 109.374 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -91.89 -13.74 23.15 Favored 'Cis proline' 0 CA--C 1.541 0.87 0 C-N-CA 130.065 1.277 . . . . 25.0 115.227 -6.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -70.71 -37.81 73.57 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.782 1.401 . . . . 25.0 114.782 -169.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.79 34.95 5.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.118 -1.808 . . . . 25.0 106.118 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.45 -174.41 46.06 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 114.613 -1.176 . . . . 25.0 111.311 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -59.8 173.71 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 124.257 3.305 . . . . 25.0 113.049 176.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.95 159.92 31.22 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.915 -1.513 . . . . 25.0 106.915 173.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -61.03 139.36 58.08 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.24 -5.05 81.98 Favored Glycine 0 C--O 1.228 -0.224 0 CA-C-N 116.06 -0.518 . . . . 25.0 112.826 -174.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -124.2 10.88 8.74 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.26 -0.644 . . . . 25.0 109.26 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.63 -49.96 74.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 122.272 -0.267 . . . . 25.0 111.291 -174.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.39 -24.66 59.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.709 -0.478 . . . . 25.0 109.709 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 p -80.45 -9.74 59.75 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.269 0.47 . . . . 25.0 112.269 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.28 34.43 14.73 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.689 0.795 . . . . 25.0 110.267 -172.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.55 41.16 26.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.467 1.284 . . . . 25.0 114.467 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -121.31 136.26 54.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.345 0.658 . . . . 25.0 110.529 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -63.5 -35.26 79.89 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -175.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.03 -7.12 47.01 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.621 0.6 . . . . 25.0 112.621 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 14.4 m-85 -120.13 13.58 12.1 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 107.14 -1.43 . . . . 25.0 107.14 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.54 -35.71 68.1 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.998 -1.064 . . . . 25.0 110.604 -175.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 -69.26 -17.37 63.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.923 0.868 . . . . 25.0 109.646 174.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.405 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.44 -5.36 59.18 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.485 -0.78 . . . . 25.0 109.007 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -113.97 -32.6 6.01 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.284 0.476 . . . . 25.0 112.284 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -91.65 115.89 28.42 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 121.583 -0.698 . . . . 25.0 110.34 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.46 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -125.17 161.02 27.79 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.149 -0.686 . . . . 25.0 109.149 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -116.55 163.96 20.2 Favored Pre-proline 0 C--N 1.317 -0.827 0 N-CA-C 100.348 -3.945 . . . . 25.0 100.348 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.88 -4.04 12.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 116.74 -1.707 . . . . 25.0 115.86 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -127.98 12.52 6.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.355 0.598 . . . . 25.0 111.506 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -76.6 -28.8 56.28 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.283 0.846 . . . . 25.0 113.283 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.46 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.4 m95 -126.14 167.12 15.83 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 120.598 0.237 . . . . 25.0 110.557 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -66.68 119.86 12.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.815 -1.921 . . . . 25.0 105.815 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -94.0 103.5 15.58 Favored 'General case' 0 CA--C 1.5 -0.975 1 N-CA-C 100.094 -4.039 . . . . 25.0 100.094 177.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.31 135.05 54.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.926 -1.034 . . . . 25.0 110.312 -176.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -90.4 101.09 13.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.648 -1.16 . . . . 25.0 108.296 -177.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -129.38 173.89 10.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.673 -1.232 . . . . 25.0 107.673 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.25 155.36 25.21 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 25.0 111.709 -174.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 66.9 p -76.99 167.99 20.87 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.1 -160.89 25.18 Favored Glycine 0 C--O 1.24 0.487 0 N-CA-C 110.609 -0.997 . . . . 25.0 110.609 -178.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.99 133.62 54.67 Favored 'Trans proline' 0 C--N 1.346 0.446 0 CA-C-N 119.019 1.41 . . . . 25.0 113.931 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -138.79 160.74 38.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.797 -1.557 . . . . 25.0 106.797 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -103.1 151.12 22.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.329 -1.359 . . . . 25.0 107.329 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -138.57 101.04 4.25 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 105.455 -2.054 . . . . 25.0 105.455 -177.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.61 116.45 32.09 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.949 0.88 . . . . 25.0 109.132 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -104.07 150.37 24.35 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.218 -0.901 . . . . 25.0 109.794 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -127.79 111.67 13.91 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.0 mp -109.22 122.36 47.16 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.633 -0.712 . . . . 25.0 111.71 -173.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.5 17.69 4.39 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.479 0.657 . . . . 25.0 111.227 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.33 140.37 33.77 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 121.615 -0.678 . . . . 25.0 110.133 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -82.55 -8.55 59.6 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.852 -0.613 . . . . 25.0 112.025 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -63.8 156.18 28.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -175.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.6 t -83.36 155.99 23.25 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 114.239 1.2 . . . . 25.0 114.239 -171.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -99.65 157.22 16.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.876 -0.602 . . . . 25.0 109.469 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -117.94 -14.22 10.03 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.559 0.207 . . . . 25.0 111.559 172.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.1 t -172.61 150.31 2.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.807 0.337 . . . . 25.0 111.824 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -122.86 139.5 53.95 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 104.521 -2.4 . . . . 25.0 104.521 166.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -144.75 151.83 39.45 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.454 -1.313 . . . . 25.0 107.454 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.94 134.39 34.89 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.75 -1.945 . . . . 25.0 105.75 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 164.01 34.72 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.345 0.52 . . . . 25.0 109.881 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.92 164.28 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 113.481 0.919 . . . . 25.0 113.481 -167.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -78.65 162.36 26.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -62.07 157.77 49.78 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.264 -0.88 . . . . 25.0 109.065 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.33 -25.34 36.31 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 116.534 -1.844 . . . . 25.0 114.036 -173.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -113.0 31.99 6.03 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.694 0.397 . . . . 25.0 110.882 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.512 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.67 165.02 25.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.031 0.919 . . . . 25.0 112.982 -175.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -83.1 100.93 10.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.496 -1.229 . . . . 25.0 109.857 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -88.14 12.2 14.28 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 116.693 2.109 . . . . 25.0 116.693 -169.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.4 t -119.23 6.45 11.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 176.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -109.71 156.62 39.44 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.666 -1.152 . . . . 25.0 108.042 -174.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.53 156.85 64.39 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 O-C-N 121.942 0.443 . . . . 25.0 111.847 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.05 105.17 3.24 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.28 0.562 . . . . 25.0 112.075 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.0 p -98.64 154.82 17.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.772 -0.825 . . . . 25.0 108.772 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -65.0 -26.05 68.12 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.913 -0.492 . . . . 25.0 111.484 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.84 -26.95 65.41 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.702 -0.681 . . . . 25.0 112.112 176.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 35.3 t -83.34 -5.39 59.13 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -101.96 153.7 19.63 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -94.86 95.42 8.66 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 102.556 -3.128 . . . . 25.0 102.556 163.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.1 mt -67.06 -6.81 18.79 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -169.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.1 t -86.95 131.28 45.42 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.951 -0.759 . . . . 25.0 108.951 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -72.64 149.63 49.36 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 115.54 -2.506 . . . . 25.0 111.446 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -99.62 -12.07 20.39 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.151 0.426 . . . . 25.0 112.151 -177.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.7 m -147.47 65.86 1.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.366 -0.379 . . . . 25.0 110.357 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -88.99 135.87 33.32 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 118.458 -1.297 . . . . 25.0 109.176 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -123.19 99.13 6.2 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 103.406 -2.813 . . . . 25.0 103.406 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -91.83 92.06 8.2 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 106.535 -1.654 . . . . 25.0 106.535 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -109.91 119.32 38.97 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 107.984 -1.117 . . . . 25.0 107.984 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.64 77.94 0.82 Allowed Glycine 0 CA--C 1.503 -0.713 0 CA-C-N 115.33 -0.85 . . . . 25.0 113.844 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.98 23.56 6.39 Favored Glycine 0 C--N 1.32 -0.306 0 C-N-CA 120.899 -0.667 . . . . 25.0 114.08 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.06 105.89 4.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.792 0.806 . . . . 25.0 110.005 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 87.7 mt -69.97 127.06 92.67 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 106.596 -1.631 . . . . 25.0 106.596 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.17 169.73 21.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 N-CA-C 113.998 0.73 . . . . 25.0 113.998 -176.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.469 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.89 30.86 4.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.784 -1.191 . . . . 25.0 107.784 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.61 -21.02 0.22 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.997 1.719 . . . . 25.0 111.969 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.469 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.7 mt-30 -126.64 156.56 40.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 104.219 -2.512 . . . . 25.0 104.219 169.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -138.96 95.07 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.134 -2.173 . . . . 25.0 105.134 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.7 t -87.84 139.98 29.97 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.936 -2.616 . . . . 25.0 103.936 174.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -152.62 166.93 30.55 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 113.883 -1.508 . . . . 25.0 108.779 -175.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -135.44 155.89 49.8 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.058 -1.83 . . . . 25.0 106.058 174.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.06 161.32 25.27 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.019 -1.474 . . . . 25.0 107.019 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -105.89 118.65 37.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.992 0.182 . . . . 25.0 110.868 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.2 131.9 61.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -61.99 147.2 95.62 Favored 'Trans proline' 0 C--N 1.353 0.784 0 CA-C-O 121.615 0.59 . . . . 25.0 113.456 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.75 -25.69 35.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 25.0 112.526 -169.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -83.58 9.74 10.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.684 0.754 . . . . 25.0 110.192 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.99 52.97 0.88 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.4 p -86.0 166.92 15.51 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.983 -1.488 . . . . 25.0 106.983 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.74 -166.76 34.43 Favored Glycine 0 C--O 1.238 0.389 0 N-CA-C 115.926 1.131 . . . . 25.0 115.926 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.0 t -86.01 107.6 17.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.436 0.636 . . . . 25.0 110.813 -168.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -157.93 171.27 20.56 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.774 -0.648 . . . . 25.0 110.871 -176.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.57 149.98 7.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.64 -1.245 . . . . 25.0 107.64 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.99 127.71 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 101.665 -3.458 . . . . 25.0 101.665 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.92 132.0 56.81 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.711 -0.477 . . . . 25.0 109.711 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -110.92 128.69 55.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.6 p -122.29 137.93 54.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.991 0.9 . . . . 25.0 111.014 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.4 t90 -115.71 116.19 27.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.783 -1.553 . . . . 25.0 107.008 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.3 126.91 40.93 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.959 -1.126 . . . . 25.0 107.959 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 18.8 mm -82.6 140.96 15.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.19 -43.07 29.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.824 0.738 . . . . 25.0 110.014 176.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.36 -23.59 64.7 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 114.092 1.145 . . . . 25.0 114.092 -172.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.4 p -138.78 169.76 17.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.993 0.901 . . . . 25.0 110.118 -174.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.28 19.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.142 -0.935 . . . . 25.0 112.491 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -90.04 146.99 23.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.852 0.686 . . . . 25.0 112.852 -176.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.03 141.74 15.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 104.576 -2.379 . . . . 25.0 104.576 170.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -146.39 134.79 21.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.262 0.467 . . . . 25.0 112.262 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -91.56 115.1 27.77 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.918 0.762 . . . . 25.0 110.808 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -97.05 108.1 20.76 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.446 -1.316 . . . . 25.0 107.446 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.38 139.99 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.377 -0.829 . . . . 25.0 111.757 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 132.86 70.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 105.311 -2.107 . . . . 25.0 105.311 167.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -94.02 130.41 40.16 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.981 -1.489 . . . . 25.0 106.981 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.4 m -131.81 161.35 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.912 0.708 . . . . 25.0 112.912 -175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -117.71 95.0 4.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 103.654 -2.721 . . . . 25.0 103.654 166.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.93 161.27 16.0 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.086 0.47 . . . . 25.0 111.825 -171.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.2 p -145.86 164.29 32.41 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.815 -0.809 . . . . 25.0 108.815 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.707 0 CA-C-O 118.041 -0.98 . . . . 25.0 110.378 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.9 m80 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.246 0.546 . . . . 25.0 110.372 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.41 177.53 35.51 Favored Glycine 0 CA--C 1.508 -0.348 1 N-CA-C 101.717 -4.553 . . . . 25.0 101.717 -176.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -148.16 165.82 29.74 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.019 1.91 . . . . 25.0 109.414 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -100.59 122.43 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 106.481 -1.674 . . . . 25.0 106.481 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.24 -43.21 52.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.708 -1.133 . . . . 25.0 109.859 -173.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.69 129.76 5.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.194 -1.78 . . . . 25.0 106.194 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.43 130.83 10.69 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.89 0.788 . . . . 25.0 111.386 -0.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.21 113.4 5.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.985 -0.552 . . . . 25.0 112.334 -172.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -72.1 158.23 36.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.038 -0.727 . . . . 25.0 109.038 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -55.32 -25.23 33.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.387 0.675 . . . . 25.0 112.02 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.35 36.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.782 0.801 . . . . 25.0 109.455 176.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -67.61 -35.7 79.44 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.456 -0.793 . . . . 25.0 110.301 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -63.6 -33.18 75.04 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 120.97 -0.292 . . . . 25.0 110.759 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -40.31 96.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.257 0.551 . . . . 25.0 110.092 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -68.14 -35.4 78.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.28 0.562 . . . . 25.0 110.071 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.88 4.43 9.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.098 -0.501 . . . . 25.0 111.518 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 58.75 23.69 11.43 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.22 1.408 . . . . 25.0 112.851 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.436 ' C ' HD21 ' A' ' 19' ' ' ASN . 87.8 mt -87.89 -22.43 24.4 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.611 -1.255 . . . . 25.0 107.611 174.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.436 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.62 159.34 29.48 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 105.316 -2.105 . . . . 25.0 105.316 177.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -135.36 175.23 9.78 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.352 -0.24 . . . . 25.0 110.352 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 70.32 5.4 5.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.783 1.771 . . . . 25.0 115.783 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.47 -34.44 77.94 Favored 'General case' 0 CA--C 1.497 -1.059 0 O-C-N 121.375 -0.828 . . . . 25.0 110.359 172.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.36 -64.14 1.38 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.9 0.75 . . . . 25.0 112.153 179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.9 t -87.98 -53.41 4.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 122.539 1.162 . . . . 25.0 111.633 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.18 -10.73 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 114.523 -1.217 . . . . 25.0 113.233 -171.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -85.5 -3.53 58.89 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.917 -0.489 . . . . 25.0 111.13 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -115.66 -34.09 4.97 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.407 -0.517 . . . . 25.0 110.005 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -126.94 98.81 29.94 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 120.672 0.273 . . . . 25.0 110.798 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -76.92 -20.77 12.92 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 117.619 -1.121 . . . . 25.0 114.312 -174.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -82.27 9.06 9.56 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.211 0.449 . . . . 25.0 112.211 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -64.94 -23.2 67.15 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.15 0.796 . . . . 25.0 113.15 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.06 122.95 15.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 115.226 1.565 . . . . 25.0 115.226 -172.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.93 159.1 42.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 105.778 -1.934 . . . . 25.0 105.778 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.15 -168.58 23.23 Favored Glycine 0 N--CA 1.454 -0.156 0 N-CA-C 108.879 -1.689 . . . . 25.0 108.879 -177.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.4 tp -115.11 147.36 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.241 1.021 . . . . 25.0 112.062 -177.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -65.56 157.03 30.84 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.033 -0.729 . . . . 25.0 109.033 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.57 0.14 2.38 Favored Glycine 0 C--O 1.222 -0.646 0 CA-C-N 114.504 -1.225 . . . . 25.0 113.732 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -75.87 138.36 69.57 Favored Pre-proline 0 C--N 1.322 -0.628 0 O-C-N 121.402 -1.057 . . . . 25.0 110.815 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -92.77 -14.73 18.69 Favored 'Cis proline' 0 CA--C 1.544 0.98 0 C-N-CA 130.259 1.358 . . . . 25.0 115.385 -7.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -69.38 -35.62 76.0 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.162 1.541 . . . . 25.0 115.162 -168.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.97 34.1 4.94 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 105.846 -1.909 . . . . 25.0 105.846 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.78 -170.75 40.36 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.489 -1.232 . . . . 25.0 111.748 -176.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -60.5 170.39 4.34 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.994 2.462 . . . . 25.0 113.104 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 159.84 31.2 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.729 -1.582 . . . . 25.0 106.729 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -61.75 140.26 58.23 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.43 85.6 Favored Glycine 0 N--CA 1.453 -0.206 0 CA-C-N 115.782 -0.645 . . . . 25.0 112.373 -174.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -125.85 12.75 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.954 -0.387 . . . . 25.0 109.954 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.45 -52.87 46.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.122 -0.361 . . . . 25.0 111.824 -173.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.15 -20.04 59.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.889 -0.507 . . . . 25.0 109.969 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 p -83.24 -9.43 59.14 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.889 -0.325 . . . . 25.0 111.826 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.07 34.21 13.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.822 0.849 . . . . 25.0 110.342 -172.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.07 37.33 24.29 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.666 1.358 . . . . 25.0 114.666 -177.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.95 134.7 55.3 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.039 0.536 . . . . 25.0 110.891 175.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 p -62.27 -33.88 75.48 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 115.19 1.552 . . . . 25.0 115.19 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 t -70.67 -8.22 50.33 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.145 0.498 . . . . 25.0 112.296 -178.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 59' ' ' LEU . 12.9 m-85 -120.5 15.83 12.06 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 107.544 -1.28 . . . . 25.0 107.544 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -70.4 -40.48 73.87 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.146 -0.971 . . . . 25.0 111.739 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.59 -15.35 63.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.91 0.862 . . . . 25.0 109.942 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.65 -6.55 59.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.73 -0.841 . . . . 25.0 108.73 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -112.28 -33.73 6.12 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.236 0.828 . . . . 25.0 113.236 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -96.21 119.41 34.64 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 121.424 -0.798 . . . . 25.0 110.907 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -125.94 161.03 28.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.971 -1.013 . . . . 25.0 109.919 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 53.8 p -116.13 160.66 34.73 Favored Pre-proline 0 C--N 1.319 -0.747 1 N-CA-C 99.857 -4.127 . . . . 25.0 99.857 160.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -70.37 -0.49 7.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 116.995 -1.537 . . . . 25.0 115.794 -174.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.93 10.02 8.83 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.108 0.48 . . . . 25.0 111.471 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -78.49 -29.28 46.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.888 0.699 . . . . 25.0 112.888 -176.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.492 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 5.6 m95 -126.65 165.55 19.0 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.856 -0.424 . . . . 25.0 109.856 -179.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -67.22 131.4 45.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -100.03 105.45 17.12 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 101.325 -3.583 . . . . 25.0 101.325 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.7 136.25 52.6 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.929 -1.032 . . . . 25.0 111.057 -177.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -87.79 106.75 18.28 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.948 -1.024 . . . . 25.0 109.051 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.1 mt -132.38 173.73 10.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 157.94 23.32 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.768 -0.651 . . . . 25.0 110.843 -174.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.8 p -77.06 169.8 17.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.099 -1.445 . . . . 25.0 107.099 172.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 89.82 -160.35 28.67 Favored Glycine 0 C--O 1.239 0.439 0 N-CA-C 110.602 -0.999 . . . . 25.0 110.602 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.27 132.32 45.99 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 119.087 1.443 . . . . 25.0 114.218 -177.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.88 161.43 36.65 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.281 -1.748 . . . . 25.0 106.281 178.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 p -104.35 151.15 23.81 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.616 -1.254 . . . . 25.0 107.616 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -139.31 100.95 4.13 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.83 115.04 29.82 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 122.169 0.985 . . . . 25.0 109.483 -179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.7 m95 -101.17 148.43 25.1 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.964 -1.016 . . . . 25.0 109.701 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.9 111.1 13.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.215 -2.143 . . . . 25.0 105.215 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.73 128.49 56.44 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.619 0.768 . . . . 25.0 111.73 -173.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -32.61 23.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.315 0.579 . . . . 25.0 109.623 174.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.4 122.01 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.842 0.353 . . . . 25.0 110.54 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -82.59 3.33 29.15 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.78 152.98 44.47 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.653 -0.419 . . . . 25.0 109.997 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -68.99 156.0 39.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 114.308 1.225 . . . . 25.0 114.308 -171.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.412 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 13.4 t -96.88 159.78 14.73 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.181 -1.044 . . . . 25.0 108.181 173.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.9 t -117.86 -16.13 9.97 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 123.143 0.277 . . . . 25.0 110.442 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.53 160.2 4.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.207 0.527 . . . . 25.0 112.224 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -128.48 134.93 48.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.071 -2.566 . . . . 25.0 104.071 168.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -140.34 150.05 43.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.873 -0.788 . . . . 25.0 108.873 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.94 138.14 38.67 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.641 -1.614 . . . . 25.0 106.641 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -149.62 161.57 41.9 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.545 0.611 . . . . 25.0 110.305 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.96 163.29 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 114.014 1.116 . . . . 25.0 114.014 -169.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 21.9 p -77.73 164.19 25.48 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.238 -1.023 . . . . 25.0 108.238 171.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -64.3 159.75 55.65 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 107.838 -1.171 . . . . 25.0 107.838 176.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -68.57 -26.37 33.9 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 115.921 -2.253 . . . . 25.0 113.983 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -114.08 32.01 6.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.881 0.473 . . . . 25.0 111.037 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.496 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -68.39 168.85 11.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.05 0.929 . . . . 25.0 112.91 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -83.17 100.97 10.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.602 -1.181 . . . . 25.0 109.461 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.496 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -92.86 8.9 37.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.895 1.813 . . . . 25.0 115.895 -169.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.4 t -125.62 13.69 8.09 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.644 -0.872 . . . . 25.0 108.644 177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -116.94 158.61 43.57 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.281 -1.327 . . . . 25.0 107.677 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -65.69 152.7 80.93 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 118.22 -0.72 . . . . 25.0 111.248 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mp -69.53 101.97 1.72 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.786 0.661 . . . . 25.0 112.786 -175.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.3 p -95.44 153.75 17.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.876 -1.157 . . . . 25.0 107.876 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -64.13 -24.51 67.72 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.065 0.459 . . . . 25.0 111.559 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.4 -26.79 67.41 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 25.0 112.415 177.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -80.59 -6.57 58.48 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.598 0.592 . . . . 25.0 112.598 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.44 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 50.5 m-85 -105.41 157.51 17.3 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -175.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.14 96.25 7.98 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 102.606 -3.109 . . . . 25.0 102.606 162.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.98 -6.82 24.24 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.938 1.459 . . . . 25.0 114.938 -169.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.4 t -79.88 133.47 58.34 Favored Pre-proline 0 C--N 1.321 -0.635 0 N-CA-C 108.995 -0.742 . . . . 25.0 108.995 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -72.37 148.38 48.73 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 114.824 -2.984 . . . . 25.0 110.596 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -102.67 -8.32 21.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.032 0.444 . . . . 25.0 111.277 -179.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.23 68.86 1.04 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.962 -0.563 . . . . 25.0 109.894 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -88.93 129.39 35.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 119.488 -0.885 . . . . 25.0 108.931 177.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -121.45 98.98 6.22 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 104.272 -2.492 . . . . 25.0 104.272 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -90.99 92.01 8.57 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.014 -1.106 . . . . 25.0 108.014 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -110.77 117.42 33.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.994 -1.484 . . . . 25.0 106.994 175.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.18 82.72 0.35 Allowed Glycine 0 CA--C 1.501 -0.819 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.717 -170.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 122.64 13.19 4.74 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 120.98 -0.628 . . . . 25.0 113.812 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.28 104.04 5.69 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.7 mt -74.76 122.83 88.35 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.51 156.8 49.61 Favored 'Trans proline' 0 C--N 1.345 0.389 0 N-CA-C 114.503 0.924 . . . . 25.0 114.503 -176.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -99.14 29.39 3.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 73.56 -15.89 0.53 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.881 1.673 . . . . 25.0 112.601 -176.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -130.55 148.97 52.41 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.5 t -142.48 94.96 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 106.996 -1.483 . . . . 25.0 106.996 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.1 t -88.71 136.89 32.77 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.9 166.94 23.27 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 106.12 -1.807 . . . . 25.0 106.12 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -133.46 152.87 51.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.415 -2.069 . . . . 25.0 105.415 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.65 159.54 33.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.795 -1.187 . . . . 25.0 107.795 -178.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -105.29 115.52 30.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.737 0.273 . . . . 25.0 111.737 -175.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.79 132.6 64.03 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 108.753 -0.832 . . . . 25.0 108.753 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -61.66 146.81 96.51 Favored 'Trans proline' 0 C--N 1.354 0.864 0 N-CA-C 113.682 0.609 . . . . 25.0 113.682 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.57 -29.56 41.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.98 -168.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -81.88 7.07 13.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.584 -0.735 . . . . 25.0 110.594 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.1 mmt-85 -114.03 51.9 0.85 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.027 -1.101 . . . . 25.0 108.027 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.09 170.96 11.73 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.557 -1.645 . . . . 25.0 106.557 175.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 86.89 -167.37 38.17 Favored Glycine 0 C--N 1.321 -0.263 0 N-CA-C 116.213 1.245 . . . . 25.0 116.213 176.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.4 t -86.03 106.91 17.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.41 0.624 . . . . 25.0 110.985 -168.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -158.2 171.25 20.54 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.907 -0.588 . . . . 25.0 111.623 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -105.7 150.22 8.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 64.2 mt -131.94 122.84 50.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -106.88 132.96 52.24 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.192 -0.913 . . . . 25.0 109.998 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.4 137.73 54.43 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 122.905 0.482 . . . . 25.0 109.76 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.6 p -128.8 138.0 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 114.04 1.126 . . . . 25.0 114.04 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.412 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.3 t90 -98.44 121.6 40.59 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 105.086 -2.191 . . . . 25.0 105.086 170.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -106.17 119.35 39.01 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.815 -1.18 . . . . 25.0 107.815 -176.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 22.2 mm -84.71 137.97 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 122.031 -0.418 . . . . 25.0 112.092 -171.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -77.9 -45.12 25.01 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.57 -0.706 . . . . 25.0 111.094 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.22 -25.9 65.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.697 1.369 . . . . 25.0 114.697 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 69.6 p -139.31 165.9 25.96 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.444 0.64 . . . . 25.0 109.607 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.62 29.84 0.25 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.555 -0.748 . . . . 25.0 112.642 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -99.05 147.94 24.53 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -177.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.32 144.94 12.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 171.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -146.75 130.62 17.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.996 0.369 . . . . 25.0 111.996 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -91.7 118.08 30.34 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.527 0.517 . . . . 25.0 110.776 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -97.17 116.74 29.93 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.875 -1.158 . . . . 25.0 107.875 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.82 140.16 29.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.951 -0.568 . . . . 25.0 112.117 -176.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -126.93 134.31 66.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 105.945 -1.872 . . . . 25.0 105.945 167.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -94.08 130.43 40.24 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 176.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.1 m -132.06 162.8 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 113.08 0.77 . . . . 25.0 113.08 -174.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -118.06 95.11 4.76 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.78 163.9 14.29 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.008 -0.542 . . . . 25.0 112.109 -172.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 63.3 p -143.83 151.82 40.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.686 -0.487 . . . . 25.0 109.686 175.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.421 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 117.791 -1.099 . . . . 25.0 112.345 -176.117 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.496 0.665 . . . . 25.0 110.389 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 170.61 36.62 Favored Glycine 0 CA--C 1.508 -0.395 1 N-CA-C 101.375 -4.69 . . . . 25.0 101.375 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -147.85 164.78 32.6 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 120.402 2.101 . . . . 25.0 110.336 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -101.03 122.3 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 107.639 -1.245 . . . . 25.0 107.639 176.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.61 -42.36 61.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.72 -1.127 . . . . 25.0 109.974 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 t -153.34 129.5 5.36 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.76 133.81 17.78 Favored 'Cis proline' 0 CA--C 1.533 0.464 0 C-N-CA 128.791 0.746 . . . . 25.0 111.103 -0.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 110.49 3.21 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.576 0.584 . . . . 25.0 112.576 -172.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.2 t -71.94 157.17 38.33 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.2 mtp180 -55.42 -24.98 33.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.478 0.711 . . . . 25.0 112.272 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.76 -53.99 38.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.826 0.822 . . . . 25.0 109.539 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -68.26 -33.06 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.501 -0.772 . . . . 25.0 110.818 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.9 -33.17 74.74 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 122.009 -0.432 . . . . 25.0 110.449 177.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -65.59 -38.99 91.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.72 -0.474 . . . . 25.0 109.72 178.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -64.48 -36.75 85.21 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.202 0.525 . . . . 25.0 110.263 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -78.22 5.8 9.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.037 -0.528 . . . . 25.0 111.473 177.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 58.73 25.74 13.78 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.137 1.375 . . . . 25.0 112.751 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.466 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.1 mt -91.78 -18.88 23.22 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.466 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -122.35 158.25 30.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 177.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.9 p -133.93 175.23 9.65 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 122.866 0.466 . . . . 25.0 109.956 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 68.12 5.29 4.55 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.848 1.796 . . . . 25.0 115.848 175.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.1 m -68.66 -35.37 77.15 Favored 'General case' 0 CA--C 1.504 -0.811 0 O-C-N 121.601 -0.687 . . . . 25.0 112.025 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.42 -62.96 1.83 Allowed Glycine 0 C--O 1.22 -0.743 0 O-C-N 123.813 0.695 . . . . 25.0 111.804 -177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -88.01 -50.1 6.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 114.74 1.385 . . . . 25.0 114.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.1 t -65.08 -13.07 14.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 114.549 -1.205 . . . . 25.0 114.146 -165.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -82.59 -9.97 59.17 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.24 -0.984 . . . . 25.0 111.563 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -105.99 -34.09 7.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.266 -0.574 . . . . 25.0 109.479 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -127.1 98.9 29.29 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.638 -0.255 . . . . 25.0 111.246 172.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.16 -21.58 20.2 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 117.281 -1.346 . . . . 25.0 113.907 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -87.97 15.26 7.49 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.193 0.442 . . . . 25.0 112.193 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.8 m -61.62 -25.27 67.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.973 0.416 . . . . 25.0 111.874 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.94 117.93 5.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 115.514 1.672 . . . . 25.0 115.514 -173.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -152.95 157.28 40.36 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 105.231 -2.137 . . . . 25.0 105.231 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.76 -164.79 16.32 Favored Glycine 0 CA--C 1.51 -0.278 0 N-CA-C 108.656 -1.778 . . . . 25.0 108.656 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -118.15 149.79 40.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.432 1.116 . . . . 25.0 112.6 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.88 156.99 31.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.012 -1.107 . . . . 25.0 108.012 171.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.55 -2.77 1.77 Allowed Glycine 0 C--O 1.225 -0.459 0 CA-C-N 114.671 -1.149 . . . . 25.0 113.418 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.69 140.68 71.53 Favored Pre-proline 0 C--N 1.323 -0.571 0 O-C-N 121.518 -0.99 . . . . 25.0 110.676 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -92.84 -14.15 19.83 Favored 'Cis proline' 0 CA--C 1.543 0.937 0 C-N-CA 130.195 1.331 . . . . 25.0 115.243 -7.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -71.79 -36.87 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.193 1.553 . . . . 25.0 115.193 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.17 34.07 5.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.5 -174.62 44.64 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 114.533 -1.212 . . . . 25.0 111.717 -176.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.53 172.67 1.9 Allowed 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 123.663 2.909 . . . . 25.0 112.85 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.16 159.96 30.99 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 106.858 -1.534 . . . . 25.0 106.858 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.04 140.76 55.41 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.097 -1.446 . . . . 25.0 107.097 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.23 -6.93 77.87 Favored Glycine 0 C--O 1.23 -0.114 0 C-N-CA 121.294 -0.479 . . . . 25.0 112.958 -174.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -124.89 9.68 8.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.376 -0.485 . . . . 25.0 109.847 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.9 mt -66.98 -50.75 61.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 122.044 -0.41 . . . . 25.0 111.405 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.06 -21.38 59.95 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.92 -0.488 . . . . 25.0 109.839 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.6 p -82.66 -9.46 59.37 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.844 -0.343 . . . . 25.0 111.821 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.29 37.61 19.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.721 0.808 . . . . 25.0 110.416 -172.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.6 t70 63.12 32.59 15.11 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.736 1.384 . . . . 25.0 114.736 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -118.97 134.54 55.12 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.785 -0.572 . . . . 25.0 111.973 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 p -62.82 -35.09 78.78 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 115.717 1.747 . . . . 25.0 115.717 -173.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.76 -8.03 49.33 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.254 0.549 . . . . 25.0 112.05 -178.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HA ' HD11 ' A' ' 59' ' ' LEU . 10.0 m-85 -121.38 14.71 11.23 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 107.734 -1.21 . . . . 25.0 107.734 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -69.16 -41.14 77.63 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.108 -0.995 . . . . 25.0 111.038 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -73.87 -11.25 60.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.913 0.863 . . . . 25.0 109.675 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 56' ' ' PHE . 3.0 mp -86.2 -3.43 58.97 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -114.48 -32.87 5.77 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.02 0.378 . . . . 25.0 112.02 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -97.46 120.66 38.23 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 121.477 -0.764 . . . . 25.0 110.299 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.422 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -125.83 160.97 28.46 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.316 -0.857 . . . . 25.0 109.684 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.5 p -114.99 161.19 30.53 Favored Pre-proline 0 C--N 1.318 -0.768 1 N-CA-C 99.58 -4.23 . . . . 25.0 99.58 160.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.57 -2.64 10.39 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 116.823 -1.651 . . . . 25.0 116.127 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -126.1 11.49 7.63 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.754 0.787 . . . . 25.0 111.282 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -79.59 -29.86 41.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.276 -0.89 . . . . 25.0 112.969 -176.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.422 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.1 m95 -125.6 167.01 15.68 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 110.022 -0.362 . . . . 25.0 110.022 -177.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -68.2 125.7 27.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 172.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -99.22 106.12 18.24 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 100.202 -3.999 . . . . 25.0 100.202 176.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.85 135.12 52.03 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.175 -0.92 . . . . 25.0 110.495 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -89.77 100.68 13.44 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.848 -1.167 . . . . 25.0 107.848 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.3 mt -131.28 174.03 10.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.244 -1.021 . . . . 25.0 108.244 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.67 155.6 24.19 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.478 -0.783 . . . . 25.0 111.666 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.2 p -77.28 167.21 22.1 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 172.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.97 -162.08 22.87 Favored Glycine 0 C--O 1.241 0.553 0 N-CA-C 110.712 -0.955 . . . . 25.0 110.712 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 133.87 56.65 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 118.958 1.379 . . . . 25.0 114.043 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.42 159.54 41.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.45 -1.685 . . . . 25.0 106.45 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.8 p -106.12 152.97 22.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 106.923 -1.51 . . . . 25.0 106.923 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -138.28 101.06 4.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 105.238 -2.134 . . . . 25.0 105.238 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.1 107.78 20.34 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.865 0.84 . . . . 25.0 110.114 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -97.21 146.47 25.06 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.426 -0.806 . . . . 25.0 110.074 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -124.89 112.11 16.24 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.67 108.5 17.98 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.437 -0.801 . . . . 25.0 111.225 -172.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -71.69 -32.73 68.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.443 0.639 . . . . 25.0 109.861 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.49 117.56 23.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.495 -0.557 . . . . 25.0 109.495 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -72.64 -5.73 39.46 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.654 1.353 . . . . 25.0 114.654 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.94 156.61 23.96 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -72.87 156.03 39.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 113.762 1.023 . . . . 25.0 113.762 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.427 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 12.4 t -99.96 157.67 16.37 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.527 -0.916 . . . . 25.0 108.527 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -118.12 -14.7 9.91 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.117 0.261 . . . . 25.0 111.617 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.7 t -172.58 152.66 2.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.849 0.356 . . . . 25.0 111.51 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 51.5 m95 -122.92 138.91 54.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 104.599 -2.371 . . . . 25.0 104.599 167.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -143.49 147.03 33.9 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -136.15 132.86 36.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.169 -1.789 . . . . 25.0 106.169 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.83 161.8 41.1 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.446 0.566 . . . . 25.0 110.197 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.29 165.96 30.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 113.427 0.899 . . . . 25.0 113.427 -167.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 17.0 p -80.36 160.3 25.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.49 -1.3 . . . . 25.0 107.49 169.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -61.89 159.41 36.3 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.29 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 -24.36 34.51 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 116.256 -2.029 . . . . 25.0 114.234 -173.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -114.43 32.05 6.21 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.398 . . . . 25.0 111.358 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.504 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -74.15 166.99 22.46 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.952 0.882 . . . . 25.0 112.87 -176.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -83.0 100.99 10.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.683 -1.144 . . . . 25.0 110.031 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.504 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.31 15.46 10.47 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 116.421 2.008 . . . . 25.0 116.421 -169.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.7 t -124.29 9.03 8.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.814 -0.81 . . . . 25.0 108.814 175.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -112.52 158.44 37.35 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 114.544 -1.207 . . . . 25.0 108.077 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.82 154.61 71.96 Favored 'Trans proline' 0 C--N 1.347 0.481 0 O-C-N 121.863 0.401 . . . . 25.0 111.953 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.05 105.14 3.8 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.364 0.602 . . . . 25.0 111.046 -177.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.6 p -94.04 154.43 17.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -63.59 -26.58 68.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.035 -0.415 . . . . 25.0 111.639 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.07 62.65 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.714 177.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.0 t -76.73 -20.79 56.13 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.627 0.727 . . . . 25.0 111.305 -178.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 55.8 m-85 -88.21 154.95 20.02 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 115.134 1.531 . . . . 25.0 115.134 -176.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -92.3 95.85 9.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 102.301 -3.222 . . . . 25.0 102.301 161.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 79.9 mt -66.96 -6.85 18.42 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.77 1.396 . . . . 25.0 114.77 -169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.0 t -85.97 130.35 50.71 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.314 -0.995 . . . . 25.0 108.314 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.93 148.99 52.55 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 115.509 -2.528 . . . . 25.0 111.457 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -100.07 -9.1 22.99 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.123 0.487 . . . . 25.0 111.266 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.0 m -149.23 69.48 1.06 Allowed 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.943 -0.571 . . . . 25.0 109.561 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -88.99 134.58 33.93 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.566 -0.854 . . . . 25.0 109.185 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.51 99.04 5.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 105.849 -1.908 . . . . 25.0 105.849 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -91.98 92.08 8.14 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -105.14 118.34 36.28 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 106.796 -1.557 . . . . 25.0 106.796 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.27 79.9 0.47 Allowed Glycine 0 CA--C 1.502 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 114.082 -167.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.84 22.44 6.63 Favored Glycine 0 C--N 1.32 -0.361 0 C-N-CA 120.861 -0.685 . . . . 25.0 112.61 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.27 105.68 5.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.415 0.626 . . . . 25.0 109.343 177.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.49 122.78 87.56 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 105.596 -2.001 . . . . 25.0 105.596 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.73 168.11 24.19 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 117.714 -1.057 . . . . 25.0 113.872 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.428 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -93.99 24.29 4.36 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.693 -0.855 . . . . 25.0 108.693 176.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.83 -17.97 0.28 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.843 1.657 . . . . 25.0 112.602 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.8 mt-30 -129.06 148.04 50.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 104.028 -2.582 . . . . 25.0 104.028 170.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.86 94.95 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.049 -1.463 . . . . 25.0 107.049 -178.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.4 m -85.71 100.06 11.74 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 107.894 -1.15 . . . . 25.0 107.894 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.08 166.53 11.55 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.303 -1.369 . . . . 25.0 107.303 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -134.64 153.58 51.91 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 170.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -164.38 160.59 20.93 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.922 -1.14 . . . . 25.0 107.922 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -105.21 117.26 33.56 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.172 0.295 . . . . 25.0 110.948 -176.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.14 130.95 67.77 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 107.924 -1.139 . . . . 25.0 107.924 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -62.2 147.31 95.26 Favored 'Trans proline' 0 C--N 1.353 0.793 0 CA-C-O 121.682 0.617 . . . . 25.0 113.402 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.11 -25.65 36.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.222 -0.899 . . . . 25.0 112.653 -169.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 p-10 -83.76 9.4 11.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.698 0.761 . . . . 25.0 110.225 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -115.13 53.3 0.83 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.189 -1.041 . . . . 25.0 108.189 171.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 32.3 p -86.11 166.69 15.6 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 106.414 -1.699 . . . . 25.0 106.414 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.16 -166.76 35.41 Favored Glycine 0 C--N 1.319 -0.384 0 N-CA-C 115.459 0.944 . . . . 25.0 115.459 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.01 108.31 18.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.488 0.661 . . . . 25.0 110.938 -168.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.9 p-80 -156.94 171.18 20.91 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.834 -0.621 . . . . 25.0 110.819 -176.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 p -107.8 150.6 10.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 49.8 mt -131.5 120.1 44.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.489 -2.041 . . . . 25.0 105.489 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.56 132.73 51.36 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.04 135.1 50.33 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.993 -0.373 . . . . 25.0 109.993 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.7 p -122.01 144.2 32.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 122.075 0.941 . . . . 25.0 112.572 -177.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.427 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.6 t90 -112.48 105.62 13.9 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.173 -2.158 . . . . 25.0 105.173 173.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.17 127.37 35.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.569 -1.271 . . . . 25.0 107.569 179.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.0 mm -83.62 140.68 15.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.768 -0.456 . . . . 25.0 109.768 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.38 -42.78 24.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.353 0.597 . . . . 25.0 110.477 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.13 -24.62 65.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.734 1.012 . . . . 25.0 113.734 -172.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.6 p -139.49 171.21 14.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.999 0.904 . . . . 25.0 110.206 -174.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.6 20.21 0.74 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.239 -0.891 . . . . 25.0 112.209 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -90.1 146.48 24.28 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.057 0.762 . . . . 25.0 113.057 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.06 144.61 11.48 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -147.95 127.19 12.98 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -84.34 117.13 23.4 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.04 0.448 . . . . 25.0 110.732 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -97.1 112.53 24.26 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.81 141.02 29.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.432 -0.804 . . . . 25.0 111.869 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.15 134.87 65.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 105.607 -1.997 . . . . 25.0 105.607 166.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -93.65 131.25 39.14 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.885 -1.524 . . . . 25.0 106.885 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.4 m -132.5 161.24 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.652 0.612 . . . . 25.0 112.652 -175.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.68 95.05 4.68 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 103.729 -2.693 . . . . 25.0 103.729 167.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.4 163.18 14.78 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 112.558 0.577 . . . . 25.0 112.558 -171.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 74.9 p -145.88 164.09 33.04 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.493 -0.929 . . . . 25.0 108.493 177.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.069 -0.967 . . . . 25.0 110.515 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.0 m80 . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.356 0.598 . . . . 25.0 110.473 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.22 169.58 35.84 Favored Glycine 0 C--N 1.32 -0.348 1 N-CA-C 101.077 -4.809 . . . . 25.0 101.077 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.456 ' HA ' HE22 ' A' ' 162' ' ' GLN . 36.7 p90 -143.97 165.71 27.0 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 120.124 1.962 . . . . 25.0 110.2 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -102.46 121.23 53.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 106.17 -1.789 . . . . 25.0 106.17 176.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -74.04 -41.43 61.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.53 -1.213 . . . . 25.0 109.553 -174.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -154.17 129.22 4.97 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 105.987 -1.857 . . . . 25.0 105.987 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -65.28 131.56 13.29 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 128.828 0.761 . . . . 25.0 111.543 -0.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 113.15 4.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.996 -0.547 . . . . 25.0 111.594 -173.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.4 p -72.13 163.71 27.44 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.273 -0.639 . . . . 25.0 109.273 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -59.73 -21.86 61.25 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.146 0.498 . . . . 25.0 111.797 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.28 -53.68 27.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.934 -0.765 . . . . 25.0 108.934 174.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.01 -35.81 81.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.684 -0.689 . . . . 25.0 110.759 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.41 -32.62 74.32 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.13 -0.356 . . . . 25.0 111.024 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 25.0 109.839 177.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -66.77 -36.09 81.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.141 0.496 . . . . 25.0 109.864 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.97 3.61 11.84 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.357 -0.383 . . . . 25.0 111.964 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 58.53 21.84 9.03 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.094 1.357 . . . . 25.0 112.836 -178.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.458 ' C ' HD21 ' A' ' 19' ' ' ASN . 95.5 mt -84.72 -21.17 30.19 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.284 -1.376 . . . . 25.0 107.284 173.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.458 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -123.19 157.73 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 104.736 -2.32 . . . . 25.0 104.736 176.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 p -135.26 176.67 8.46 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.575 -0.528 . . . . 25.0 109.575 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 69.83 5.05 5.04 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.536 1.68 . . . . 25.0 115.536 174.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -68.06 -38.84 82.91 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 121.402 -0.811 . . . . 25.0 110.844 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.32 -63.81 1.74 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.683 0.614 . . . . 25.0 112.037 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -87.97 -52.45 5.26 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 122.503 1.144 . . . . 25.0 111.889 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.86 -11.82 14.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.469 -1.241 . . . . 25.0 113.248 -171.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -85.6 -1.44 57.13 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 121.739 -0.601 . . . . 25.0 111.487 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.41 -34.08 4.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.056 -0.657 . . . . 25.0 110.349 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -127.04 95.79 35.99 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 120.7 0.286 . . . . 25.0 110.349 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -70.63 -19.39 32.04 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 115.05 1.134 . . . . 25.0 115.05 -177.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -87.02 10.92 14.96 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.772 -0.58 . . . . 25.0 112.404 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.9 m -62.52 -18.29 61.64 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.559 0.577 . . . . 25.0 112.559 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.1 m -64.13 122.35 14.86 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 114.875 1.435 . . . . 25.0 114.875 -175.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -153.04 155.23 36.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.601 -1.629 . . . . 25.0 106.601 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.62 -167.09 19.77 Favored Glycine 0 CA--C 1.512 -0.123 0 N-CA-C 107.838 -2.105 . . . . 25.0 107.838 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 tp -117.93 149.77 40.35 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.536 1.168 . . . . 25.0 111.891 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -65.02 156.93 29.81 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.36 -1.348 . . . . 25.0 107.36 171.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.89 4.57 2.98 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-N 114.848 -1.069 . . . . 25.0 113.73 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -75.99 143.22 73.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 121.528 -0.983 . . . . 25.0 109.263 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.22 -16.93 17.24 Favored 'Cis proline' 0 CA--C 1.543 0.934 0 N-CA-C 115.635 1.36 . . . . 25.0 115.635 -5.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -70.85 -37.75 73.15 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.95 1.463 . . . . 25.0 114.95 -169.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -113.26 28.47 8.76 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.067 -1.827 . . . . 25.0 106.067 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.09 -176.43 45.06 Favored Glycine 0 N--CA 1.445 -0.702 0 CA-C-N 114.567 -1.197 . . . . 25.0 110.692 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.59 175.17 1.77 Allowed 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 123.781 2.987 . . . . 25.0 113.222 177.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.04 160.03 31.01 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.683 -1.599 . . . . 25.0 106.683 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.25 140.07 57.23 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 175.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.33 -5.9 83.26 Favored Glycine 0 C--O 1.229 -0.212 0 CA-C-O 121.349 0.416 . . . . 25.0 112.785 -174.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 60.1 m170 -125.76 8.88 7.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.453 -0.44 . . . . 25.0 110.962 178.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.8 mt -64.52 -46.8 91.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 121.915 -0.491 . . . . 25.0 110.968 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.39 -12.09 59.98 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.078 -0.389 . . . . 25.0 110.482 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 p -94.0 -7.58 42.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.01 33.97 12.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.555 0.742 . . . . 25.0 110.758 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.38 32.55 19.06 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.339 1.237 . . . . 25.0 114.339 -178.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -118.46 137.61 53.05 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.124 0.488 . . . . 25.0 111.608 176.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.85 -34.88 78.27 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 115.233 1.568 . . . . 25.0 115.233 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.5 t -71.46 -7.41 47.26 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.27 0.557 . . . . 25.0 112.468 -177.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.407 ' HA ' ' CD1' ' A' ' 59' ' ' LEU . 16.3 m-85 -120.37 12.5 11.69 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 107.161 -1.422 . . . . 25.0 107.161 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -72.12 -35.08 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.081 -1.012 . . . . 25.0 110.171 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mp0 -70.08 -16.56 63.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.897 0.856 . . . . 25.0 109.864 175.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.407 ' CD1' ' HA ' ' A' ' 56' ' ' PHE . 1.3 mp -87.42 -5.93 58.64 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 -176.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -114.14 -31.96 6.16 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 112.384 0.513 . . . . 25.0 112.384 174.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -95.1 118.15 31.41 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.539 -0.726 . . . . 25.0 110.342 -178.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.442 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -126.38 161.01 28.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.109 -0.701 . . . . 25.0 109.109 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.1 p -118.81 161.6 35.28 Favored Pre-proline 0 C--N 1.317 -0.813 0 N-CA-C 100.245 -3.983 . . . . 25.0 100.245 162.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.4 -5.09 15.13 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 116.728 -1.715 . . . . 25.0 115.588 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.4 t -123.66 10.03 9.0 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.063 0.459 . . . . 25.0 111.71 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -79.07 -30.46 43.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.724 0.638 . . . . 25.0 112.724 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 14.5 m95 -123.51 165.78 16.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 120.698 0.285 . . . . 25.0 110.516 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -67.72 129.17 39.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 105.471 -2.048 . . . . 25.0 105.471 169.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -100.15 105.84 17.49 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 101.249 -3.612 . . . . 25.0 101.249 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.75 135.79 54.51 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.819 -1.082 . . . . 25.0 109.93 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -93.43 106.17 18.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.826 -1.079 . . . . 25.0 109.091 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -131.64 173.71 10.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.655 -1.239 . . . . 25.0 107.655 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.73 157.34 23.32 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.727 -0.669 . . . . 25.0 110.421 -176.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 66.8 p -77.28 166.76 22.77 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.921 -1.511 . . . . 25.0 106.921 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.52 -161.78 23.18 Favored Glycine 0 C--O 1.241 0.539 0 N-CA-C 110.336 -1.106 . . . . 25.0 110.336 -177.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.23 132.54 47.33 Favored 'Trans proline' 0 C--N 1.346 0.408 0 CA-C-N 119.147 1.473 . . . . 25.0 114.288 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -138.93 161.31 37.64 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.1 p -103.43 150.91 23.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -138.15 100.92 4.27 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.467 -2.049 . . . . 25.0 105.467 -178.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.78 116.13 31.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 122.041 0.924 . . . . 25.0 110.023 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -100.48 149.2 23.93 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.151 -0.931 . . . . 25.0 109.85 178.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -127.92 115.05 17.96 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.494 -2.409 . . . . 25.0 104.494 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -114.37 121.93 45.13 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.101 -0.954 . . . . 25.0 110.791 -172.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.4 t -74.48 -29.72 61.55 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.51 0.671 . . . . 25.0 110.141 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.62 133.38 35.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.03 0.443 . . . . 25.0 110.856 -177.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -77.92 -5.77 52.18 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.748 0.648 . . . . 25.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -63.97 156.86 26.6 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.353 0.872 . . . . 25.0 113.353 -175.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.4 t -77.63 155.97 31.08 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.561 1.319 . . . . 25.0 114.561 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -103.67 156.23 17.95 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.024 -0.535 . . . . 25.0 109.711 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -118.03 -14.81 9.96 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.227 0.454 . . . . 25.0 112.227 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.4 t -172.54 154.1 3.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.976 0.417 . . . . 25.0 111.525 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.3 m95 -128.06 134.73 49.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.83 -2.285 . . . . 25.0 104.83 168.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -141.0 149.61 41.99 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.373 -0.973 . . . . 25.0 108.373 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -137.95 135.29 35.89 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 105.731 -1.951 . . . . 25.0 105.731 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.98 160.9 42.88 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.183 0.447 . . . . 25.0 109.938 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.35 166.5 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 112.736 0.643 . . . . 25.0 112.736 -167.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 p -79.6 158.7 27.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -62.32 158.91 44.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.109 -0.95 . . . . 25.0 109.859 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.52 -15.64 38.11 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 117.894 -0.937 . . . . 25.0 114.179 -174.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -118.66 32.06 6.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.721 0.408 . . . . 25.0 111.882 -176.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.538 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -79.14 161.58 26.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.819 0.819 . . . . 25.0 112.076 -177.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -83.11 101.03 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.703 -1.135 . . . . 25.0 110.098 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.538 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -83.98 16.68 2.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 116.928 2.195 . . . . 25.0 116.928 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -123.87 5.16 8.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.587 0.708 . . . . 25.0 109.179 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -108.71 157.45 36.68 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 114.838 -1.074 . . . . 25.0 108.499 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.71 154.9 70.08 Favored 'Trans proline' 0 C--N 1.346 0.415 0 O-C-N 121.968 0.457 . . . . 25.0 112.695 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.26 112.25 9.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.321 0.581 . . . . 25.0 110.945 -177.028 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.8 p -104.7 156.8 17.66 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -63.82 -27.04 68.9 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 122.087 -0.383 . . . . 25.0 111.735 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -25.16 61.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.91 -0.586 . . . . 25.0 112.075 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.2 t -78.29 -20.43 51.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.177 0.513 . . . . 25.0 111.149 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -89.78 153.86 20.36 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 115.077 1.51 . . . . 25.0 115.077 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -90.8 97.93 11.47 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 103.133 -2.914 . . . . 25.0 103.133 162.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -67.46 -5.87 16.86 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.82 1.415 . . . . 25.0 114.82 -170.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -88.44 128.64 52.27 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.206 -1.035 . . . . 25.0 108.206 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.04 145.73 50.5 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.325 -2.65 . . . . 25.0 111.422 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -95.17 -9.13 34.32 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.916 0.389 . . . . 25.0 111.788 -177.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 55.6 m -151.39 69.35 0.94 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.082 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.15 133.57 34.35 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 118.775 -1.17 . . . . 25.0 109.858 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.36 99.06 6.27 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -93.26 92.07 7.54 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 107.229 -1.397 . . . . 25.0 107.229 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -108.81 118.36 36.6 Favored 'General case' 0 C--O 1.216 -0.675 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 178.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -93.61 76.63 1.09 Allowed Glycine 0 CA--C 1.503 -0.705 0 CA-C-N 115.434 -0.803 . . . . 25.0 114.772 -168.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 105.11 25.34 6.79 Favored Glycine 0 C--N 1.319 -0.388 0 C-N-CA 121.011 -0.614 . . . . 25.0 113.122 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.89 106.35 3.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.649 0.738 . . . . 25.0 109.724 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.05 123.72 88.8 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 106.712 -1.588 . . . . 25.0 106.712 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.33 172.41 15.4 Favored 'Trans proline' 0 C--N 1.344 0.327 0 N-CA-C 113.887 0.687 . . . . 25.0 113.887 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.447 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -99.53 27.68 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.017 -1.105 . . . . 25.0 108.017 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.24 -9.84 0.58 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.622 1.569 . . . . 25.0 112.129 -173.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.447 ' H ' ' C ' ' A' ' 128' ' ' ALA . 60.8 mt-30 -131.48 151.65 51.39 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 103.849 -2.649 . . . . 25.0 103.849 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -142.1 95.18 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 106.924 -1.51 . . . . 25.0 106.924 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.5 t -94.37 126.88 39.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 107.179 -1.415 . . . . 25.0 107.179 175.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -133.17 166.92 21.33 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 105.299 -2.111 . . . . 25.0 105.299 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -131.33 151.07 51.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 173.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.07 158.95 37.39 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.791 -1.189 . . . . 25.0 107.791 -177.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -102.21 116.17 32.1 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.091 0.245 . . . . 25.0 111.15 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.8 mt -76.91 131.26 73.65 Favored Pre-proline 0 C--O 1.241 0.606 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.37 146.41 97.26 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-O 121.655 0.606 . . . . 25.0 113.527 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.01 -26.24 36.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.186 -0.915 . . . . 25.0 112.588 -168.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -84.31 10.78 9.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 25.0 110.172 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.5 mmt-85 -116.15 50.65 1.02 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.45 -0.944 . . . . 25.0 108.45 171.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.0 p -85.86 164.63 17.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.491 -1.3 . . . . 25.0 107.491 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.69 -166.91 31.81 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 114.648 0.619 . . . . 25.0 114.648 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.3 t -86.02 112.43 21.22 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.353 0.596 . . . . 25.0 110.354 -169.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -159.46 172.27 18.2 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.711 -0.677 . . . . 25.0 110.317 -176.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.07 151.69 10.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.3 mt -133.13 122.32 45.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 104.895 -2.261 . . . . 25.0 104.895 -178.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.41 134.55 50.3 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.557 -0.747 . . . . 25.0 109.919 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -125.12 134.44 52.45 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.791 0.436 . . . . 25.0 110.078 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.21 142.91 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 122.322 1.058 . . . . 25.0 112.438 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -111.49 114.58 27.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 105.737 -1.949 . . . . 25.0 105.737 173.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -94.69 122.31 37.16 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.842 -1.17 . . . . 25.0 107.842 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.5 mm -78.69 142.42 14.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.543 -0.54 . . . . 25.0 109.543 -177.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.54 -42.94 21.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.924 0.784 . . . . 25.0 110.108 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -23.89 64.79 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.649 0.981 . . . . 25.0 113.649 -172.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.3 p -139.09 168.61 19.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.901 0.858 . . . . 25.0 109.988 -175.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.24 21.39 0.75 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.285 -0.871 . . . . 25.0 112.334 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -90.7 147.27 23.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.35 143.41 11.94 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 105.916 -1.883 . . . . 25.0 105.916 173.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -148.07 128.54 14.02 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.72 0.267 . . . . 25.0 111.72 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -86.96 117.76 25.9 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 120.74 0.305 . . . . 25.0 110.859 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . 0.456 HE22 ' HA ' ' A' ' 3' ' ' TYR . 78.0 mt-30 -97.24 118.7 34.27 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 176.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -87.89 142.5 27.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.713 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.85 134.85 65.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 105.298 -2.112 . . . . 25.0 105.298 166.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.71 129.54 42.89 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 177.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -132.97 162.11 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 113.454 0.909 . . . . 25.0 113.454 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -117.89 95.11 4.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 104.56 -2.385 . . . . 25.0 104.56 168.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.14 163.66 14.76 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 112.397 0.517 . . . . 25.0 112.397 -173.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.3 p -145.74 162.95 36.42 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.896 -1.15 . . . . 25.0 107.896 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.443 ' C ' ' HZ1' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 117.96 -1.019 . . . . 25.0 110.879 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 21.5 m80 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 121.341 0.591 . . . . 25.0 110.602 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.43 164.46 30.52 Favored Glycine 0 C--N 1.321 -0.262 1 N-CA-C 99.904 -5.278 . . . . 25.0 99.904 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -145.6 162.03 38.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.968 2.384 . . . . 25.0 111.625 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.01 121.62 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 107.95 -1.129 . . . . 25.0 107.95 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -76.02 -42.78 46.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.456 -1.247 . . . . 25.0 109.809 -175.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.2 t -152.86 128.83 5.19 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 106.154 -1.795 . . . . 25.0 106.154 177.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.99 131.74 11.89 Favored 'Cis proline' 0 CA--C 1.534 0.483 0 C-N-CA 128.771 0.738 . . . . 25.0 111.193 -0.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.44 112.61 4.15 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 25.0 112.242 -171.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.9 t -71.97 157.82 37.12 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.378 -0.971 . . . . 25.0 108.378 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -56.12 -24.24 39.46 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.478 0.711 . . . . 25.0 111.826 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.7 -53.09 37.33 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.736 0.779 . . . . 25.0 109.337 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -66.86 -36.72 82.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.599 -0.728 . . . . 25.0 110.482 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -63.38 -31.02 72.07 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.985 -0.286 . . . . 25.0 110.755 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -40.63 95.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.192 0.52 . . . . 25.0 110.276 178.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.466 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.4 tmtm? -70.19 -33.55 71.86 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.04 0.448 . . . . 25.0 110.09 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -76.14 2.53 12.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.385 -0.37 . . . . 25.0 111.488 174.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 58.1 22.78 9.37 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.353 1.461 . . . . 25.0 113.093 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.451 ' C ' HD21 ' A' ' 19' ' ' ASN . 94.8 mt -85.83 -21.86 27.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.148 -1.427 . . . . 25.0 107.148 173.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.451 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.89 159.08 30.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.9 p -136.72 175.96 9.14 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.881 -0.414 . . . . 25.0 109.881 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 72.62 5.22 5.19 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.523 1.675 . . . . 25.0 115.523 173.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -67.77 -36.51 80.62 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.671 -0.643 . . . . 25.0 111.282 173.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -63.25 1.67 Allowed Glycine 0 C--O 1.218 -0.858 0 O-C-N 123.552 0.532 . . . . 25.0 112.241 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -88.09 -53.86 4.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.5 1.143 . . . . 25.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -7.15 7.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.401 -171.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.73 3.16 51.82 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.844 -0.535 . . . . 25.0 111.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -119.77 -33.99 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.272 -0.571 . . . . 25.0 110.911 173.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.98 107.46 22.07 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 107.746 -1.205 . . . . 25.0 107.746 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.466 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.7 Cg_endo -73.05 -19.23 23.24 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 116.276 -2.016 . . . . 25.0 114.389 -175.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -85.92 9.37 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.356 0.502 . . . . 25.0 112.356 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -61.4 -18.29 58.15 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.814 0.672 . . . . 25.0 112.814 178.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.4 m -65.29 124.21 19.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 114.721 1.378 . . . . 25.0 114.721 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -152.97 158.8 42.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.303 -1.74 . . . . 25.0 106.303 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.84 -166.57 18.99 Favored Glycine 0 N--CA 1.453 -0.172 0 N-CA-C 107.395 -2.282 . . . . 25.0 107.395 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.79 149.52 43.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 118.487 1.144 . . . . 25.0 112.31 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -67.03 156.93 34.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 107.126 -1.435 . . . . 25.0 107.126 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.18 -5.41 1.9 Allowed Glycine 0 C--N 1.318 -0.457 0 CA-C-N 114.953 -1.022 . . . . 25.0 112.394 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -75.97 145.85 78.15 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.25 -1.018 . . . . 25.0 108.25 -178.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -90.08 -19.99 13.05 Favored 'Cis proline' 0 CA--C 1.542 0.883 0 N-CA-C 115.859 1.446 . . . . 25.0 115.859 -4.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -71.08 -35.61 71.93 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.576 1.324 . . . . 25.0 114.576 -169.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.69 35.98 4.19 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.64 -1.985 . . . . 25.0 105.64 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -85.45 175.69 49.51 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.735 -1.121 . . . . 25.0 110.941 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.39 172.93 3.81 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 123.134 2.556 . . . . 25.0 113.616 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.0 30.99 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.203 -1.777 . . . . 25.0 106.203 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.71 139.56 57.83 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.504 -1.225 . . . . 25.0 107.725 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 -4.98 84.88 Favored Glycine 0 C--O 1.227 -0.316 0 C-N-CA 121.279 -0.486 . . . . 25.0 113.125 -174.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 55.1 m170 -124.82 10.28 8.3 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.349 -0.5 . . . . 25.0 109.816 177.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.1 mt -66.25 -45.27 90.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.31 -0.244 . . . . 25.0 110.903 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.44 -27.61 60.68 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.546 -0.539 . . . . 25.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.3 p -79.93 -7.66 58.89 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.459 0.911 . . . . 25.0 113.459 -176.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 35.53 18.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.582 0.753 . . . . 25.0 110.294 -173.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.8 OUTLIER 62.42 30.34 17.29 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.646 1.35 . . . . 25.0 114.646 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -117.51 137.33 52.62 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.828 -0.545 . . . . 25.0 111.992 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.99 -35.89 81.73 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 115.585 1.698 . . . . 25.0 115.585 -173.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.3 t -71.31 -4.87 28.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.522 0.564 . . . . 25.0 112.522 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -123.39 11.9 9.36 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -73.57 -34.79 65.31 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.152 -0.968 . . . . 25.0 109.813 -176.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -71.61 -14.06 61.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.871 0.843 . . . . 25.0 109.419 175.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.6 mp -90.46 -2.26 57.93 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.43 -32.19 6.0 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.312 0.577 . . . . 25.0 110.969 173.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.8 115.03 24.97 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 121.773 -0.579 . . . . 25.0 110.193 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -127.62 160.92 30.13 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.129 0.49 . . . . 25.0 110.027 176.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.401 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 33.0 p -119.87 162.45 33.03 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 100.384 -3.932 . . . . 25.0 100.384 162.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -70.12 -3.44 12.26 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 116.32 -1.987 . . . . 25.0 115.853 -175.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -122.37 7.74 9.62 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.656 0.741 . . . . 25.0 111.529 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -76.87 -28.54 55.45 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.345 -0.847 . . . . 25.0 113.204 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.481 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.3 m95 -126.92 167.23 16.14 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.741 0.305 . . . . 25.0 111.337 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -67.77 119.92 13.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.944 -1.873 . . . . 25.0 105.944 169.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.7 mmtt -95.43 105.24 17.19 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 100.507 -3.886 . . . . 25.0 100.507 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 135.32 54.6 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.664 -1.153 . . . . 25.0 110.291 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -92.0 101.73 14.28 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.173 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.6 mt -130.23 173.94 10.29 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.207 -1.034 . . . . 25.0 108.207 -175.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.85 157.33 22.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.364 -0.835 . . . . 25.0 111.224 -175.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 68.5 p -77.36 167.82 21.06 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.854 -1.535 . . . . 25.0 106.854 173.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.75 -161.87 23.97 Favored Glycine 0 C--O 1.241 0.543 0 N-CA-C 110.856 -0.897 . . . . 25.0 110.856 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.93 133.57 54.48 Favored 'Trans proline' 0 C--N 1.345 0.346 0 CA-C-N 118.989 1.394 . . . . 25.0 114.289 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -140.46 160.26 40.38 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.168 -1.79 . . . . 25.0 106.168 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 p -104.41 152.36 22.4 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 178.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -138.34 100.99 4.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 105.618 -1.993 . . . . 25.0 105.618 -178.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.86 119.21 38.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.876 0.846 . . . . 25.0 109.006 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.6 m95 -104.63 148.0 27.02 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.031 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -127.75 107.71 10.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.97 125.09 50.87 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 123.958 0.903 . . . . 25.0 112.187 -175.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -80.46 -20.22 44.27 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.297 -1.001 . . . . 25.0 108.297 168.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.85 108.62 16.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.85 -0.614 . . . . 25.0 111.586 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -77.63 0.57 22.72 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.869 1.433 . . . . 25.0 114.869 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.6 154.33 42.15 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.057 0.389 . . . . 25.0 110.21 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.5 t -70.57 155.91 40.11 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -171.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.2 t -97.78 159.37 14.97 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.281 -1.007 . . . . 25.0 108.281 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.5 t -117.77 -16.19 10.02 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 123.145 0.278 . . . . 25.0 111.322 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.5 t -172.13 153.24 3.05 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.991 0.424 . . . . 25.0 112.112 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.88 138.29 53.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 103.837 -2.653 . . . . 25.0 103.837 167.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -142.64 147.24 35.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -135.35 133.47 38.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -147.26 163.22 37.09 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.303 -0.628 . . . . 25.0 109.303 178.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.04 164.93 32.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 114.465 1.283 . . . . 25.0 114.465 -167.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.08 158.28 26.47 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 106.934 -1.506 . . . . 25.0 106.934 168.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -63.14 158.72 53.49 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.241 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.89 -20.55 38.92 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 116.681 -1.746 . . . . 25.0 114.252 -174.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -120.55 32.05 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.552 0.575 . . . . 25.0 112.552 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.524 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -71.89 165.51 24.0 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.932 0.873 . . . . 25.0 111.558 -179.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.04 101.01 10.84 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.725 -1.125 . . . . 25.0 109.706 -179.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.524 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.16 15.21 6.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.636 2.087 . . . . 25.0 116.636 -169.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.4 t -124.17 9.24 8.61 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -113.16 156.63 42.69 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 107.465 -1.309 . . . . 25.0 107.465 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.57 156.31 66.19 Favored 'Trans proline' 0 C--N 1.345 0.343 0 O-C-N 121.918 0.431 . . . . 25.0 112.016 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.52 104.24 3.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.187 0.517 . . . . 25.0 111.395 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.3 p -92.61 159.56 15.42 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -65.69 -25.97 67.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.159 0.504 . . . . 25.0 110.719 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.58 -22.48 60.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.481 -0.782 . . . . 25.0 112.745 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 21.2 m -77.39 -12.11 59.92 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.07 0.396 . . . . 25.0 112.07 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -99.77 158.35 15.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 114.555 1.317 . . . . 25.0 114.555 -175.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -96.02 98.23 10.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 102.38 -3.193 . . . . 25.0 102.38 161.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 74.8 mt -66.86 -7.62 23.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 115.003 1.483 . . . . 25.0 115.003 -169.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -83.8 131.37 52.1 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 108.706 -0.85 . . . . 25.0 108.706 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -72.54 150.44 51.38 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 115.15 -2.767 . . . . 25.0 111.047 177.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -102.25 -11.85 18.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.399 . . . . 25.0 111.603 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 64.0 m -149.84 66.87 0.99 Allowed 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 116.234 -0.439 . . . . 25.0 110.742 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -89.06 133.47 34.34 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.078 -1.049 . . . . 25.0 109.01 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -123.78 99.07 6.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 104.833 -2.284 . . . . 25.0 104.833 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.9 92.11 8.19 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.129 -1.434 . . . . 25.0 107.129 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -105.98 118.2 36.0 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.065 -1.457 . . . . 25.0 107.065 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.99 82.45 0.37 Allowed Glycine 0 CA--C 1.501 -0.826 0 CA-C-N 115.476 -0.784 . . . . 25.0 112.609 -170.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.4 13.99 6.06 Favored Glycine 0 C--N 1.32 -0.332 0 C-N-CA 120.998 -0.62 . . . . 25.0 113.357 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.49 104.0 5.04 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.514 0.673 . . . . 25.0 109.542 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 83.6 mt -73.57 124.5 90.42 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 106.367 -1.716 . . . . 25.0 106.367 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.47 158.74 53.28 Favored 'Trans proline' 0 C--N 1.345 0.384 0 N-CA-C 113.645 0.594 . . . . 25.0 113.645 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.447 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.48 28.66 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.81 -17.92 0.33 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.962 1.705 . . . . 25.0 111.508 -173.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.447 ' H ' ' C ' ' A' ' 128' ' ' ALA . 50.2 mt-30 -127.68 150.8 49.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 104.668 -2.345 . . . . 25.0 104.668 169.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 46.0 t -141.02 95.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 106.764 -1.569 . . . . 25.0 106.764 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.9 t -89.65 126.88 35.8 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 107.509 -1.293 . . . . 25.0 107.509 175.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.11 166.86 20.16 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 105.443 -2.058 . . . . 25.0 105.443 177.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -136.01 152.7 51.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 104.825 -2.287 . . . . 25.0 104.825 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.69 159.35 30.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.525 -0.917 . . . . 25.0 108.525 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -103.8 115.69 30.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.391 -0.368 . . . . 25.0 110.902 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.01 131.57 72.74 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 107.891 -1.151 . . . . 25.0 107.891 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.94 147.11 95.85 Favored 'Trans proline' 0 C--N 1.354 0.861 0 CA-C-O 121.642 0.601 . . . . 25.0 113.504 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -80.61 -26.77 37.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.132 -0.94 . . . . 25.0 112.745 -168.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -82.67 8.45 11.99 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.565 0.698 . . . . 25.0 110.321 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -114.5 51.87 0.87 Allowed 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.816 0.817 . . . . 25.0 109.144 173.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.7 p -85.98 163.33 18.05 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 93.6 -169.28 29.95 Favored Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 115.243 0.857 . . . . 25.0 115.243 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.05 108.33 18.21 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.358 0.599 . . . . 25.0 110.86 -168.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -157.39 169.44 24.72 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.86 -0.609 . . . . 25.0 112.015 -176.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.3 148.16 10.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 N-CA-C 108.427 -0.953 . . . . 25.0 108.427 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 65.7 mt -131.03 121.21 49.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 104.776 -2.305 . . . . 25.0 104.776 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.14 130.52 53.3 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.32 -0.855 . . . . 25.0 109.963 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.16 123.9 46.65 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.043 -0.725 . . . . 25.0 109.043 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.9 p -114.11 137.78 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.952 0.882 . . . . 25.0 111.653 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -112.09 118.99 36.92 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.933 -1.506 . . . . 25.0 106.933 176.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.71 126.45 45.75 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.745 -0.835 . . . . 25.0 108.745 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.3 mm -80.84 143.05 12.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 109.071 -0.714 . . . . 25.0 109.071 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.98 -45.98 17.47 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.724 0.693 . . . . 25.0 110.212 175.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -68.13 -22.55 64.87 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.45 1.278 . . . . 25.0 114.45 -172.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -137.45 168.52 19.48 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.965 0.888 . . . . 25.0 110.084 -174.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.41 21.4 0.62 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.097 -0.956 . . . . 25.0 112.533 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -93.62 146.34 23.89 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.024 0.75 . . . . 25.0 113.024 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.34 143.62 15.18 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.088 -2.19 . . . . 25.0 105.088 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -148.51 136.05 20.53 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.958 0.725 . . . . 25.0 112.958 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -92.0 113.99 26.42 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.199 0.599 . . . . 25.0 111.598 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.1 108.67 21.45 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.056 -0.72 . . . . 25.0 109.056 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.24 142.19 30.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.596 -0.729 . . . . 25.0 112.198 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.5 136.37 61.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.264 -2.125 . . . . 25.0 105.264 166.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -97.73 130.35 44.7 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 176.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.56 162.8 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 112.74 0.645 . . . . 25.0 112.74 -174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -118.25 95.04 4.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 104.348 -2.464 . . . . 25.0 104.348 167.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -89.99 163.72 14.82 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 112.242 0.46 . . . . 25.0 112.242 -171.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.6 p -143.42 154.96 44.24 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 176.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.418 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.135 -0.936 . . . . 25.0 111.086 -178.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.0 m170 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.891 0.377 . . . . 25.0 110.658 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.55 165.89 20.37 Favored Glycine 0 C--O 1.229 -0.167 1 N-CA-C 102.362 -4.295 . . . . 25.0 102.362 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -148.04 163.55 36.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 120.561 2.181 . . . . 25.0 111.916 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -100.2 123.36 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -77.8 -42.61 33.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.604 -1.18 . . . . 25.0 110.265 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -152.45 129.23 5.5 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.91 131.55 11.4 Favored 'Cis proline' 0 C--N 1.348 0.502 0 CA-C-N 118.83 0.618 . . . . 25.0 111.118 -0.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 109.87 2.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.931 -0.577 . . . . 25.0 112.15 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 t -72.03 157.55 37.59 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -56.09 -24.3 39.41 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.337 0.655 . . . . 25.0 111.985 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.12 -53.69 41.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.803 0.811 . . . . 25.0 109.262 175.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -67.11 -36.42 81.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 25.0 110.463 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -61.92 -32.55 72.96 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 121.106 -0.237 . . . . 25.0 111.028 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -40.84 97.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.306 0.574 . . . . 25.0 110.519 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.441 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.77 -33.04 70.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.066 0.46 . . . . 25.0 110.031 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.1 mt -76.12 5.4 6.83 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.425 -0.352 . . . . 25.0 111.777 175.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 62.9 14.82 7.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.621 1.168 . . . . 25.0 113.352 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.459 ' C ' HD21 ' A' ' 19' ' ' ASN . 91.1 mt -84.06 -22.55 31.18 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.719 -0.845 . . . . 25.0 108.719 176.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.459 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.7 m120 -124.46 158.91 31.7 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 104.792 -2.299 . . . . 25.0 104.792 176.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.9 p -137.65 174.01 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.081 -0.341 . . . . 25.0 110.081 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 70.25 5.02 5.13 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 116.681 2.104 . . . . 25.0 116.681 176.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.7 m -64.57 -32.33 73.94 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 121.916 -0.49 . . . . 25.0 110.388 172.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 -63.08 1.79 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.818 0.699 . . . . 25.0 112.023 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.6 t -88.06 -53.48 4.7 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.611 1.196 . . . . 25.0 111.587 -178.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -68.1 -12.72 16.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.376 -1.284 . . . . 25.0 112.931 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -84.69 -0.82 54.89 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 121.852 -0.53 . . . . 25.0 111.865 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -117.56 -34.16 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.047 -0.661 . . . . 25.0 110.376 172.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.04 104.67 22.63 Favored Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 109.531 -0.544 . . . . 25.0 109.531 171.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.441 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.6 Cg_endo -74.89 -19.78 17.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 116.758 -1.695 . . . . 25.0 113.963 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -86.37 12.85 9.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.934 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -66.48 -14.0 61.62 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.754 0.312 . . . . 25.0 111.613 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 19.4 m -64.02 129.23 27.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 113.839 1.051 . . . . 25.0 113.839 -177.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -152.93 152.4 31.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.383 -1.34 . . . . 25.0 107.383 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.86 -172.96 27.74 Favored Glycine 0 N--CA 1.455 -0.094 0 N-CA-C 108.843 -1.703 . . . . 25.0 108.843 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.0 148.27 47.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 118.426 1.113 . . . . 25.0 111.827 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.14 156.92 32.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.12 -1.437 . . . . 25.0 107.12 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.42 2.13 2.99 Favored Glycine 0 C--N 1.318 -0.45 0 CA-C-N 114.929 -1.032 . . . . 25.0 112.919 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -75.91 141.39 71.52 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -93.0 -13.46 20.96 Favored 'Cis proline' 0 CA--C 1.543 0.948 0 C-N-CA 130.474 1.447 . . . . 25.0 115.469 -6.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.88 -37.07 75.93 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.483 1.29 . . . . 25.0 114.483 -169.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.01 30.91 6.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.251 -2.129 . . . . 25.0 105.251 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.98 179.05 43.92 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.899 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -62.6 173.0 3.91 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.743 2.295 . . . . 25.0 113.628 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.01 30.99 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -60.54 140.02 57.52 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 107.001 -1.481 . . . . 25.0 107.001 174.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.03 -5.01 78.42 Favored Glycine 0 N--CA 1.459 0.176 0 CA-C-O 121.817 0.676 . . . . 25.0 112.583 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -126.03 8.4 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.998 -0.741 . . . . 25.0 108.998 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.94 -52.76 49.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 122.308 -0.245 . . . . 25.0 111.637 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.57 -21.11 59.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.372 -0.603 . . . . 25.0 109.372 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.0 p -81.86 -7.62 59.62 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.597 0.592 . . . . 25.0 112.597 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.29 31.19 11.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.512 0.725 . . . . 25.0 110.33 -173.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.57 36.58 25.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.715 1.376 . . . . 25.0 114.715 -176.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -120.73 136.29 54.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.992 0.517 . . . . 25.0 110.585 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.08 -33.89 75.27 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 115.234 1.568 . . . . 25.0 115.234 -174.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.12 -7.15 44.62 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.622 0.601 . . . . 25.0 112.622 -178.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 m-85 -120.84 13.09 11.43 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -71.37 -37.23 71.64 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.243 -0.91 . . . . 25.0 111.338 -176.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -69.82 -17.98 63.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.294 1.045 . . . . 25.0 108.757 177.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.4 ' CD1' ' HA ' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -85.51 -8.19 58.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.081 -0.963 . . . . 25.0 109.174 -177.384 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -113.12 -36.13 5.16 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.671 1.36 . . . . 25.0 114.671 176.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -104.92 125.94 51.46 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.102 -0.999 . . . . 25.0 110.821 -176.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.5 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.4 pm0 -127.73 161.05 29.84 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.286 -1.325 . . . . 25.0 110.029 -176.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -112.6 162.66 20.54 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 100.663 -3.829 . . . . 25.0 100.663 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -70.45 -0.14 7.04 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 N-CA-C 116.129 1.55 . . . . 25.0 116.129 -174.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -127.92 13.64 6.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.587 0.708 . . . . 25.0 110.251 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -30.48 45.19 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.825 1.046 . . . . 25.0 113.825 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.5 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 15.8 m95 -126.77 167.89 15.16 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.599 -0.519 . . . . 25.0 109.599 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -66.46 126.89 30.27 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.246 -1.761 . . . . 25.0 106.246 171.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -98.97 106.19 18.42 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 100.543 -3.873 . . . . 25.0 100.543 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.63 134.66 52.77 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.06 -0.973 . . . . 25.0 110.259 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -91.69 100.66 13.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.691 -1.14 . . . . 25.0 108.021 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.5 mt -131.89 173.96 10.65 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.135 -1.061 . . . . 25.0 108.135 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.78 156.38 23.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.944 -176.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 53.3 p -77.13 167.9 20.99 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.163 -1.421 . . . . 25.0 107.163 172.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.26 -160.78 23.04 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 110.518 -1.033 . . . . 25.0 110.518 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.87 132.98 50.81 Favored 'Trans proline' 0 C--N 1.345 0.387 0 CA-C-N 119.202 1.501 . . . . 25.0 114.079 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.31 161.98 36.39 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.7 p -101.52 150.86 22.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.829 -1.175 . . . . 25.0 107.829 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -137.66 100.96 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.98 121.46 45.41 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 123.923 0.889 . . . . 25.0 109.52 -177.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -107.36 152.18 24.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.035 -0.984 . . . . 25.0 110.161 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -129.35 114.54 16.33 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 104.789 -2.3 . . . . 25.0 104.789 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.8 mp -115.05 117.87 31.8 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.193 -173.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -81.91 6.58 15.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.302 0.572 . . . . 25.0 111.272 173.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -122.62 132.32 54.23 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.979 -0.451 . . . . 25.0 110.345 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -80.63 -9.63 59.78 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.874 0.694 . . . . 25.0 112.874 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.15 155.58 31.16 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.19 0.441 . . . . 25.0 112.19 -176.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 t -76.99 155.89 32.3 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.819 0.818 . . . . 25.0 112.859 -175.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.461 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 6.6 t -97.92 158.24 15.64 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.502 -1.296 . . . . 25.0 107.502 173.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -117.92 -15.6 9.98 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.102 0.251 . . . . 25.0 111.195 172.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -171.99 150.25 2.52 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.312 0.486 . . . . 25.0 112.312 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -123.94 138.54 54.45 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.457 -2.423 . . . . 25.0 104.457 167.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.6 mtt-85 -137.27 144.76 42.87 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -137.94 127.52 25.05 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.686 -1.598 . . . . 25.0 106.686 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -147.74 168.76 21.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.675 -0.861 . . . . 25.0 108.675 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.51 167.38 26.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 113.394 0.887 . . . . 25.0 113.394 -168.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.3 p -79.06 160.53 27.07 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.735 . . . . 25.0 106.317 167.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -62.13 159.0 41.66 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.708 -0.678 . . . . 25.0 109.553 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.26 -24.53 37.6 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 116.923 -1.584 . . . . 25.0 113.056 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -115.02 32.06 6.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.092 0.557 . . . . 25.0 110.762 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.532 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -72.68 165.42 24.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.135 0.969 . . . . 25.0 113.577 -174.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -83.17 101.04 10.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.377 -1.283 . . . . 25.0 110.293 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.532 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.93 7.99 28.34 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 117.715 2.487 . . . . 25.0 117.715 -168.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.0 t -123.44 8.32 9.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.778 0.799 . . . . 25.0 109.231 176.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -107.25 160.52 26.18 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 114.541 -1.209 . . . . 25.0 108.916 -172.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -64.53 152.51 81.42 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 118.051 -0.833 . . . . 25.0 111.412 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -71.59 100.14 2.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.498 0.666 . . . . 25.0 110.868 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -88.96 153.97 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.503 -1.295 . . . . 25.0 107.503 176.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.21 -25.93 68.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.257 0.551 . . . . 25.0 111.167 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.47 61.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.333 -0.849 . . . . 25.0 112.801 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.4 t -79.29 -3.93 48.36 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.196 0.443 . . . . 25.0 112.196 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -106.01 155.58 19.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -96.47 91.24 5.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 101.952 -3.351 . . . . 25.0 101.952 161.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.82 -7.11 37.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -171.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.39 119.6 77.79 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.862 -1.162 . . . . 25.0 107.862 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -72.09 143.27 39.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 114.998 -2.868 . . . . 25.0 112.416 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -95.0 -14.59 24.22 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.064 0.394 . . . . 25.0 112.064 -176.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 75.1 m -147.94 62.77 1.12 Allowed 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.827 0.306 . . . . 25.0 111.827 178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -88.96 139.46 30.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 118.24 -1.384 . . . . 25.0 108.705 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -124.92 99.12 5.99 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -92.47 92.12 7.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.016 -1.476 . . . . 25.0 107.016 -176.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -106.15 117.9 35.24 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.438 -0.949 . . . . 25.0 108.438 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -96.92 77.88 0.69 Allowed Glycine 0 CA--C 1.504 -0.628 0 CA-C-N 115.45 -0.795 . . . . 25.0 114.023 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.93 20.39 5.3 Favored Glycine 0 C--N 1.321 -0.275 0 C-N-CA 120.882 -0.675 . . . . 25.0 113.862 178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.38 105.13 5.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.497 0.665 . . . . 25.0 109.828 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.24 125.99 91.24 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 105.563 -2.014 . . . . 25.0 105.563 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.5 169.14 23.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 118.369 -0.621 . . . . 25.0 113.598 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.457 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.22 31.49 4.26 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.372 -1.344 . . . . 25.0 107.372 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.66 -17.94 0.27 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.94 1.696 . . . . 25.0 112.132 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.457 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.9 mt-30 -129.25 155.47 45.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 104.703 -2.332 . . . . 25.0 104.703 171.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.1 t -140.72 95.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.417 -2.068 . . . . 25.0 105.417 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.9 t -95.52 142.58 27.7 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -156.95 167.03 31.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 113.709 -1.587 . . . . 25.0 108.628 -175.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -129.77 156.89 43.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.88 -1.526 . . . . 25.0 106.88 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.12 161.35 31.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.483 -1.302 . . . . 25.0 107.483 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -105.09 117.16 33.3 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.085 0.241 . . . . 25.0 111.101 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.54 132.25 69.48 Favored Pre-proline 0 CA--C 1.541 0.628 0 N-CA-C 107.888 -1.152 . . . . 25.0 107.888 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -61.26 145.75 98.14 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-O 121.705 0.627 . . . . 25.0 113.472 -179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.62 -25.64 35.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.178 -0.919 . . . . 25.0 112.665 -168.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -84.24 9.77 12.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.611 0.719 . . . . 25.0 110.212 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -115.18 53.55 0.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.345 -0.983 . . . . 25.0 108.345 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.9 p -86.12 165.45 16.59 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 106.748 -1.575 . . . . 25.0 106.748 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.14 -167.08 32.68 Favored Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 115.368 0.907 . . . . 25.0 115.368 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.7 t -86.0 108.13 18.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.959 0.409 . . . . 25.0 110.799 -168.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 38.5 p-80 -158.53 168.39 27.04 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 113.816 1.043 . . . . 25.0 113.816 -174.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 16.1 t -100.91 146.24 9.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.376 -0.972 . . . . 25.0 108.376 -179.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.81 129.65 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 102.114 -3.291 . . . . 25.0 102.114 179.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.44 132.57 54.98 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.522 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -113.09 111.88 22.88 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -106.31 142.19 19.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.356 0.598 . . . . 25.0 110.087 -176.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.461 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 18.2 t90 -123.63 124.31 42.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.0 -1.0 . . . . 25.0 108.608 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -105.21 129.46 53.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.998 -0.742 . . . . 25.0 108.998 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.2 mm -85.97 141.11 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.313 -0.625 . . . . 25.0 109.313 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.78 20.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.714 0.688 . . . . 25.0 110.528 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -23.33 64.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.077 1.14 . . . . 25.0 114.077 -171.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.5 p -138.39 169.9 16.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 122.046 0.926 . . . . 25.0 110.32 -174.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.97 19.05 0.73 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.999 -1.0 . . . . 25.0 112.325 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -90.3 147.62 23.38 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.66 -0.65 . . . . 25.0 112.528 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.05 144.67 19.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 104.414 -2.439 . . . . 25.0 104.414 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -143.43 147.94 35.37 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.721 0.237 . . . . 25.0 110.51 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -109.4 107.76 18.04 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.856 0.863 . . . . 25.0 109.666 -174.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.13 20.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.189 0.519 . . . . 25.0 110.142 -177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.56 145.93 26.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.953 -0.567 . . . . 25.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.87 147.09 32.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 103.782 -2.673 . . . . 25.0 103.782 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -110.75 130.64 55.52 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.241 -1.762 . . . . 25.0 106.241 176.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.0 m -132.76 162.45 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.738 0.644 . . . . 25.0 112.738 -173.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -117.98 95.12 4.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 104.336 -2.468 . . . . 25.0 104.336 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.89 163.99 13.83 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 112.919 0.711 . . . . 25.0 112.919 -171.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.4 p -144.74 164.43 31.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.977 -1.12 . . . . 25.0 107.977 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.839 0 CA-C-O 117.592 -1.194 . . . . 25.0 111.959 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.1 m170 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.332 -0.248 . . . . 25.0 110.332 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.33 165.14 33.04 Favored Glycine 0 CA--C 1.509 -0.284 1 N-CA-C 102.887 -4.085 . . . . 25.0 102.887 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -145.78 158.4 43.86 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 119.668 1.734 . . . . 25.0 110.984 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.15 119.56 34.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.72 -43.15 48.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.279 -1.328 . . . . 25.0 109.319 -174.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.8 t -155.37 128.38 4.26 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -63.9 128.52 7.13 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 C-N-CA 129.706 1.128 . . . . 25.0 112.346 0.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.75 116.83 8.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.777 0.658 . . . . 25.0 112.777 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.4 t -72.11 157.84 37.02 Favored 'General case' 0 C--O 1.216 -0.665 0 N-CA-C 109.011 -0.737 . . . . 25.0 109.011 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.93 -25.12 41.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.602 0.761 . . . . 25.0 111.656 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -52.76 44.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.755 0.788 . . . . 25.0 109.155 175.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.94 -36.72 84.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 25.0 110.308 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -63.65 -33.74 76.29 Favored 'General case' 0 C--O 1.219 -0.531 0 O-C-N 122.223 -0.298 . . . . 25.0 110.899 178.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -40.26 96.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.342 0.591 . . . . 25.0 109.915 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.412 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 6.3 tmtm? -68.45 -33.85 74.92 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.212 0.529 . . . . 25.0 110.311 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.5 mt -79.08 5.14 12.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 25.0 111.276 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 58.7 24.77 12.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.177 1.391 . . . . 25.0 112.909 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.442 ' C ' HD21 ' A' ' 19' ' ' ASN . 89.3 mt -89.7 -21.44 22.72 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.914 -1.143 . . . . 25.0 107.914 174.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.442 HD21 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.51 160.28 27.3 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 105.669 -1.974 . . . . 25.0 105.669 177.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 42.6 p -134.31 175.13 9.78 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 122.449 0.3 . . . . 25.0 110.456 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 69.39 5.23 5.03 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.877 1.806 . . . . 25.0 115.877 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -66.67 -38.52 86.99 Favored 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 121.344 -0.848 . . . . 25.0 111.145 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -63.33 1.54 Allowed Glycine 0 C--O 1.218 -0.9 0 O-C-N 123.55 0.531 . . . . 25.0 112.449 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -53.73 4.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.549 1.166 . . . . 25.0 111.806 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -7.03 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.603 -1.18 . . . . 25.0 113.63 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -88.27 2.0 53.32 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.8 -0.563 . . . . 25.0 111.102 178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -117.65 -34.05 4.36 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.742 -0.383 . . . . 25.0 110.791 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -126.93 107.62 22.2 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 172.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.412 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 84.1 Cg_endo -76.9 -18.55 14.71 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 116.867 -1.622 . . . . 25.0 113.797 -171.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -90.66 12.01 20.34 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.64 0.607 . . . . 25.0 112.64 -177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.0 m -62.18 -17.93 59.5 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.092 0.472 . . . . 25.0 112.121 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.1 120.65 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.81 0.814 . . . . 25.0 112.695 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -152.99 156.5 38.96 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.56 -169.05 24.34 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -176.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.7 tp -118.18 147.77 43.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.216 1.008 . . . . 25.0 111.917 -176.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.46 156.88 31.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 172.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 139.95 1.69 1.76 Allowed Glycine 0 C--O 1.223 -0.536 0 CA-C-N 114.768 -1.105 . . . . 25.0 113.195 179.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -75.99 139.07 69.07 Favored Pre-proline 0 C--N 1.321 -0.655 0 O-C-N 121.569 -0.959 . . . . 25.0 109.631 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.2 -13.13 21.23 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 C-N-CA 130.438 1.433 . . . . 25.0 115.509 -6.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -71.63 -36.76 70.86 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -168.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.69 31.95 5.74 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.26 -174.42 42.05 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.336 -1.302 . . . . 25.0 110.859 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -61.96 170.26 6.33 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.446 2.097 . . . . 25.0 113.097 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 159.97 31.12 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 106.592 -1.633 . . . . 25.0 106.592 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.62 138.84 58.01 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.563 -1.199 . . . . 25.0 108.34 177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.36 -4.12 82.46 Favored Glycine 0 C--O 1.227 -0.296 0 C-N-CA 121.216 -0.516 . . . . 25.0 112.844 -174.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -124.45 9.08 8.42 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.656 -0.868 . . . . 25.0 108.656 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.79 -47.27 86.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 O-C-N 122.405 -0.185 . . . . 25.0 110.906 -172.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.02 -18.46 58.13 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.024 -0.423 . . . . 25.0 110.182 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 p -87.97 -7.17 57.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.41 32.81 11.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.659 0.784 . . . . 25.0 110.412 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.96 37.08 24.69 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -177.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -120.7 137.28 54.55 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.124 0.569 . . . . 25.0 111.11 175.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.7 p -62.62 -35.43 79.54 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.378 1.621 . . . . 25.0 115.378 -174.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -71.56 -6.97 44.68 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.615 0.598 . . . . 25.0 112.615 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.41 ' HA ' HD11 ' A' ' 59' ' ' LEU . 14.6 m-85 -120.44 11.91 11.51 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 107.32 -1.363 . . . . 25.0 107.32 -179.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.62 -34.47 67.35 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.051 -1.031 . . . . 25.0 110.084 -175.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -71.27 -15.56 62.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.947 0.879 . . . . 25.0 109.945 174.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.91 -6.48 58.04 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 -177.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.55 -32.36 6.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.097 0.475 . . . . 25.0 111.81 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -98.15 121.91 40.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 121.743 -0.598 . . . . 25.0 110.052 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.453 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -129.68 160.97 31.69 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.022 -0.733 . . . . 25.0 109.022 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.7 p -115.79 162.39 25.64 Favored Pre-proline 0 C--N 1.321 -0.666 1 N-CA-C 100.108 -4.034 . . . . 25.0 100.108 162.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.9 -4.9 14.34 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 116.744 -1.704 . . . . 25.0 115.586 -175.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -125.15 10.7 8.13 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.079 0.466 . . . . 25.0 111.783 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -77.72 -30.14 51.59 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.657 -0.652 . . . . 25.0 112.593 -176.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 10.4 m95 -125.07 164.7 19.63 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.85 -0.426 . . . . 25.0 109.85 -178.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -66.83 129.15 38.95 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 171.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -100.9 105.54 16.81 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 100.694 -3.817 . . . . 25.0 100.694 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.9 mp -68.54 136.31 52.92 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.12 -0.946 . . . . 25.0 110.784 -176.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -88.26 111.92 22.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.915 -1.039 . . . . 25.0 108.856 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.1 mt -137.09 173.19 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.143 -1.058 . . . . 25.0 108.143 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.22 156.3 25.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.704 -0.68 . . . . 25.0 110.467 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.5 p -76.95 170.47 16.45 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 92.44 -161.87 26.54 Favored Glycine 0 C--O 1.239 0.456 0 CA-C-O 118.95 -0.917 . . . . 25.0 110.95 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -58.94 131.2 40.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 CA-C-N 119.149 1.475 . . . . 25.0 113.517 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -139.26 163.11 33.33 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.093 -1.447 . . . . 25.0 107.093 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.8 p -104.17 152.45 22.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.03 -1.1 . . . . 25.0 108.03 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -140.62 101.09 4.01 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 104.917 -2.253 . . . . 25.0 104.917 -177.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.98 134.98 49.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -120.35 153.21 36.79 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.962 -1.472 . . . . 25.0 109.542 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -130.44 117.25 19.39 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 104.21 -2.515 . . . . 25.0 104.21 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.9 137.64 52.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.139 -0.937 . . . . 25.0 111.22 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.8 t -92.75 2.36 56.78 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.984 0.421 . . . . 25.0 111.219 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -128.57 139.46 52.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.932 0.396 . . . . 25.0 111.142 -177.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.3 mmm-85 -92.06 1.77 56.99 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.895 -0.593 . . . . 25.0 112.49 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.25 148.81 49.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.591 -0.444 . . . . 25.0 110.083 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.4 t -71.8 155.93 39.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.078 1.14 . . . . 25.0 114.078 -170.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.8 t -99.03 159.45 14.95 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.179 -1.045 . . . . 25.0 108.179 173.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -117.96 -13.75 10.03 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.125 0.266 . . . . 25.0 110.589 170.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.62 151.87 2.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.803 0.335 . . . . 25.0 111.325 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 63.1 m95 -122.72 141.51 51.71 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.274 -2.491 . . . . 25.0 104.274 165.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -145.34 152.98 40.74 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.727 -1.212 . . . . 25.0 107.727 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -136.71 134.81 37.58 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.786 -1.931 . . . . 25.0 105.786 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.59 165.23 31.0 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.196 0.453 . . . . 25.0 109.822 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.01 167.83 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 113.713 1.005 . . . . 25.0 113.713 -166.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.9 p -82.25 163.78 21.62 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.235 -1.024 . . . . 25.0 108.235 168.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.39 159.38 41.26 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.349 -0.842 . . . . 25.0 109.355 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.87 -24.23 34.2 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 116.063 -2.158 . . . . 25.0 113.581 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -115.58 31.87 6.43 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 122.915 0.486 . . . . 25.0 111.069 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . 0.512 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 7.0 p-90 -71.98 166.57 21.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.13 0.967 . . . . 25.0 112.524 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.06 101.04 10.87 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.51 -1.223 . . . . 25.0 109.212 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.11 15.13 10.76 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 116.041 1.867 . . . . 25.0 116.041 -169.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -128.1 13.2 6.71 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.701 -0.852 . . . . 25.0 108.701 176.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -117.54 157.24 48.11 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.521 -1.218 . . . . 25.0 107.976 -174.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -64.93 153.2 79.33 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 O-C-N 121.961 0.453 . . . . 25.0 111.798 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.63 103.77 4.34 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.58 0.705 . . . . 25.0 112.308 -175.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 19.9 p -98.02 161.41 13.74 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.157 -0.683 . . . . 25.0 109.157 177.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -68.03 -23.39 64.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.234 0.54 . . . . 25.0 111.029 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.69 63.4 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.212 -0.904 . . . . 25.0 112.034 176.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.3 m -85.65 -9.73 56.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.115 0.483 . . . . 25.0 111.415 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -95.54 154.58 17.13 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 114.363 1.245 . . . . 25.0 114.363 -177.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -97.74 94.27 6.85 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 102.512 -3.144 . . . . 25.0 102.512 161.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.47 -7.51 20.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.569 1.322 . . . . 25.0 114.569 -170.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -81.79 132.47 54.43 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.061 -0.718 . . . . 25.0 109.061 177.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -72.66 150.92 51.54 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 115.01 -2.86 . . . . 25.0 110.615 176.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -102.32 -9.84 20.01 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.961 0.41 . . . . 25.0 111.17 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 47.7 m -151.86 70.82 0.95 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 25.0 109.793 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.08 135.14 33.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.06 -1.056 . . . . 25.0 108.964 176.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -121.22 99.1 6.3 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.168 -2.901 . . . . 25.0 103.168 177.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -90.32 91.93 8.7 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -113.68 118.44 34.36 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 107.763 -1.199 . . . . 25.0 107.763 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.32 83.71 0.38 Allowed Glycine 0 CA--C 1.5 -0.874 0 CA-C-N 115.311 -0.859 . . . . 25.0 112.564 -170.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.33 14.04 6.64 Favored Glycine 0 C--N 1.32 -0.313 0 C-N-CA 121.054 -0.593 . . . . 25.0 113.253 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.31 105.56 5.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.58 0.705 . . . . 25.0 109.334 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -74.39 121.62 85.64 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 107.039 -1.467 . . . . 25.0 107.039 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -72.32 162.89 40.28 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 118.267 -0.689 . . . . 25.0 112.933 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.14 27.58 5.51 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.665 -0.865 . . . . 25.0 108.665 179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.03 -9.79 0.82 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.604 1.561 . . . . 25.0 111.676 -174.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 128' ' ' ALA . 51.5 mt-30 -132.26 151.81 51.65 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 103.49 -2.782 . . . . 25.0 103.49 170.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 49.4 t -142.03 95.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.638 . . . . 25.0 106.576 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -90.99 138.36 31.67 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.49 164.93 30.97 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 106.287 -1.746 . . . . 25.0 106.287 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -136.46 149.01 48.01 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.962 -2.236 . . . . 25.0 104.962 174.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 160.94 31.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.328 -1.36 . . . . 25.0 107.328 -176.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -101.16 118.44 36.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.528 0.204 . . . . 25.0 111.368 -177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.3 mt -78.94 132.64 63.35 Favored Pre-proline 0 CA--C 1.541 0.625 0 N-CA-C 107.831 -1.174 . . . . 25.0 107.831 176.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -61.52 146.84 96.64 Favored 'Trans proline' 0 C--N 1.355 0.872 0 CA-C-O 121.611 0.588 . . . . 25.0 113.492 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.84 -26.83 33.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.162 -0.927 . . . . 25.0 112.56 -169.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -84.35 9.48 13.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.582 -0.736 . . . . 25.0 110.376 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -113.32 52.98 0.78 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.677 -0.86 . . . . 25.0 108.677 171.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.1 p -85.99 161.72 18.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.48 -165.41 31.14 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 115.562 0.985 . . . . 25.0 115.562 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.1 t -85.82 109.05 18.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.443 0.64 . . . . 25.0 111.267 -168.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.5 p-80 -158.31 171.51 20.04 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.777 -0.647 . . . . 25.0 110.379 -176.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.37 150.64 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.5 mt -132.99 129.29 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 N-CA-C 101.478 -3.527 . . . . 25.0 101.478 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 137.53 53.58 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.102 -0.499 . . . . 25.0 109.78 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -119.02 134.68 55.04 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 109.561 -0.533 . . . . 25.0 109.561 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -124.52 140.09 48.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.126 0.965 . . . . 25.0 111.762 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -111.44 109.7 19.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 113.495 -1.684 . . . . 25.0 106.675 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -91.08 121.5 32.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.431 -1.322 . . . . 25.0 107.431 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.2 mm -79.65 141.75 14.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.528 -0.545 . . . . 25.0 109.528 -178.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.33 -42.14 23.51 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.699 0.681 . . . . 25.0 110.163 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.0 -24.72 65.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.592 0.96 . . . . 25.0 113.592 -172.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 63.5 p -139.53 169.52 17.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.938 0.875 . . . . 25.0 110.084 -174.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.04 23.67 0.55 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.193 -0.912 . . . . 25.0 112.295 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -92.77 146.28 23.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.991 0.738 . . . . 25.0 112.991 -176.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.25 143.12 10.35 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.785 -1.932 . . . . 25.0 105.785 172.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -148.77 132.87 17.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 111.676 0.25 . . . . 25.0 111.676 178.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.12 114.9 26.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.414 0.446 . . . . 25.0 110.821 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -97.11 108.14 20.81 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.65 -0.87 . . . . 25.0 108.65 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.26 139.9 35.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.236 -0.893 . . . . 25.0 113.201 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -125.98 132.69 70.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.998 -1.853 . . . . 25.0 105.998 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -91.39 130.28 37.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.377 -1.342 . . . . 25.0 107.377 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.83 162.19 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.941 0.719 . . . . 25.0 112.941 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -119.95 95.64 4.85 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 104.47 -2.418 . . . . 25.0 104.47 168.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.03 163.23 14.99 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.483 0.549 . . . . 25.0 112.483 -172.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.2 p -143.36 156.31 44.65 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.944 -1.132 . . . . 25.0 107.944 176.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.453 ' HZ2' ' C ' ' A' ' 170' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.013 -0.994 . . . . 25.0 111.466 -177.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.8 m80 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.951 0.405 . . . . 25.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.89 177.27 33.86 Favored Glycine 0 CA--C 1.508 -0.352 1 N-CA-C 101.928 -4.469 . . . . 25.0 101.928 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -145.84 163.95 33.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 119.973 1.886 . . . . 25.0 109.689 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -100.74 122.01 52.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 106.497 -1.668 . . . . 25.0 106.497 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.23 -42.37 59.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.634 -1.166 . . . . 25.0 109.684 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.7 t -153.53 130.18 5.63 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 105.653 -1.98 . . . . 25.0 105.653 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -65.2 132.13 14.46 Favored 'Cis proline' 0 C--N 1.346 0.433 0 CA-C-N 118.783 0.601 . . . . 25.0 111.09 -0.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.37 111.14 3.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.074 -0.512 . . . . 25.0 111.887 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 t -72.21 157.52 37.58 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 109.06 -0.718 . . . . 25.0 109.06 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.44 -24.66 31.82 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.625 0.77 . . . . 25.0 111.757 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.07 -54.61 23.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.933 0.873 . . . . 25.0 109.52 176.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.23 -37.18 84.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.175 -0.921 . . . . 25.0 110.204 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -62.52 -33.29 74.59 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 122.313 -0.242 . . . . 25.0 110.963 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -39.39 93.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.011 0.434 . . . . 25.0 110.725 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.04 -35.49 74.33 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.183 0.516 . . . . 25.0 109.669 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.1 mt -74.58 2.61 9.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.162 -0.472 . . . . 25.0 111.561 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 58.19 23.39 10.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.413 1.485 . . . . 25.0 112.926 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.0 mt -84.96 -21.82 29.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 173.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -124.02 158.75 31.4 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.243 -2.132 . . . . 25.0 105.243 176.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 p -136.94 176.59 8.57 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.431 -0.581 . . . . 25.0 109.431 -177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 70.51 4.93 5.16 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.579 1.696 . . . . 25.0 115.579 174.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -67.83 -32.54 73.15 Favored 'General case' 0 CA--C 1.496 -1.113 0 O-C-N 121.354 -0.841 . . . . 25.0 110.563 172.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.19 -63.58 1.34 Allowed Glycine 0 C--O 1.215 -1.063 0 O-C-N 123.923 0.765 . . . . 25.0 112.151 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.6 t -88.08 -52.59 5.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.366 1.079 . . . . 25.0 112.343 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -65.97 -15.29 18.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.57 -1.196 . . . . 25.0 112.849 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HG2' ' H ' ' A' ' 26' ' ' GLN . 14.6 pt20 -84.33 -3.03 58.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.916 -0.49 . . . . 25.0 111.464 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -117.21 -35.65 3.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.182 -0.607 . . . . 25.0 110.264 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -127.0 94.06 40.33 Favored Pre-proline 0 C--O 1.243 0.76 0 N-CA-C 111.83 0.308 . . . . 25.0 111.83 171.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.2 Cg_endo -74.02 -20.64 19.13 Favored 'Trans proline' 0 C--N 1.346 0.396 0 N-CA-C 115.121 1.162 . . . . 25.0 115.121 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -83.74 9.34 12.04 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.851 -0.531 . . . . 25.0 112.123 -177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.8 m -66.65 -16.05 63.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.789 0.663 . . . . 25.0 112.789 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.6 m -63.97 125.35 20.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.759 1.022 . . . . 25.0 113.759 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -152.95 153.64 33.39 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 105.891 -1.892 . . . . 25.0 105.891 178.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.4 -167.66 16.69 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 108.891 -1.684 . . . . 25.0 108.891 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.0 tp -123.92 142.04 51.5 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.261 1.03 . . . . 25.0 111.506 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.07 157.0 29.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.822 -1.177 . . . . 25.0 107.822 172.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 132.19 6.98 2.97 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 114.804 -1.089 . . . . 25.0 113.507 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -75.77 139.65 70.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 O-C-N 121.564 -0.963 . . . . 25.0 108.889 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -91.87 -15.56 18.95 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 N-CA-C 115.826 1.433 . . . . 25.0 115.826 -5.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -69.18 -36.71 77.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.15 1.537 . . . . 25.0 115.15 -169.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.14 30.28 7.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.641 -1.985 . . . . 25.0 105.641 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.36 -178.0 42.95 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.397 -1.274 . . . . 25.0 110.824 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -62.1 171.75 4.76 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 122.957 2.438 . . . . 25.0 113.391 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.92 160.02 31.12 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.8 -1.556 . . . . 25.0 106.8 173.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.73 138.7 58.07 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 107.694 -1.224 . . . . 25.0 107.694 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.68 -4.71 81.36 Favored Glycine 0 CA--C 1.51 -0.258 0 C-N-CA 121.267 -0.492 . . . . 25.0 113.045 -174.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -124.01 10.02 8.78 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.74 -0.837 . . . . 25.0 108.74 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.68 -49.77 75.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.716 -0.22 . . . . 25.0 111.516 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.07 -21.47 56.71 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.813 -0.554 . . . . 25.0 109.732 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.6 p -82.75 -8.01 59.62 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.565 0.58 . . . . 25.0 112.565 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.19 33.49 12.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.594 0.757 . . . . 25.0 110.547 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.16 39.12 26.3 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.838 1.422 . . . . 25.0 114.838 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -121.38 135.46 55.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.025 -0.534 . . . . 25.0 110.654 175.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -62.24 -34.4 76.45 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 115.05 1.5 . . . . 25.0 115.05 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -70.66 -11.48 60.97 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.341 0.591 . . . . 25.0 112.275 -178.325 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -115.42 13.12 16.45 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 107.474 -1.306 . . . . 25.0 107.474 -178.042 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -70.74 -37.11 73.43 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.015 -1.053 . . . . 25.0 110.7 -175.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.9 mp0 -69.42 -15.3 63.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.746 0.784 . . . . 25.0 110.421 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.94 -7.67 57.96 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -113.2 -33.54 5.95 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.423 0.527 . . . . 25.0 112.423 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -94.31 121.68 36.08 Favored 'General case' 0 CA--C 1.505 -0.774 0 O-C-N 121.602 -0.686 . . . . 25.0 109.697 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.423 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -129.41 161.0 31.37 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.57 -0.741 . . . . 25.0 109.024 177.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.6 p -118.42 161.46 35.23 Favored Pre-proline 0 C--N 1.319 -0.748 1 N-CA-C 99.978 -4.082 . . . . 25.0 99.978 162.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -69.95 0.04 6.36 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 116.993 -1.538 . . . . 25.0 115.923 -174.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.2 t -127.29 9.25 6.66 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.336 0.495 . . . . 25.0 112.336 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -82.26 -31.15 30.29 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.094 1.146 . . . . 25.0 114.094 -175.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.423 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 15.0 m95 -119.61 164.95 15.09 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 110.41 -0.218 . . . . 25.0 110.41 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -67.54 120.09 13.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.908 -1.886 . . . . 25.0 105.908 171.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -94.7 103.09 15.0 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 100.849 -3.76 . . . . 25.0 100.849 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.18 135.09 55.04 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.935 -1.03 . . . . 25.0 110.397 -177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -89.59 100.88 13.59 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.515 -1.22 . . . . 25.0 107.921 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.4 mt -130.26 173.85 10.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 -176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.64 157.08 23.58 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.584 -0.734 . . . . 25.0 111.008 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.405 HG21 ' HA ' ' A' ' 139' ' ' ALA . 58.6 p -77.12 167.12 22.31 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 106.703 -1.591 . . . . 25.0 106.703 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.14 -160.62 24.03 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 110.487 -1.045 . . . . 25.0 110.487 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.06 132.57 48.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 119.122 1.461 . . . . 25.0 114.43 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -138.58 161.68 36.47 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.13 -1.804 . . . . 25.0 106.13 177.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.8 p -103.38 149.85 24.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -137.14 100.97 4.41 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 105.521 -2.029 . . . . 25.0 105.521 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.31 114.72 28.8 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.105 0.955 . . . . 25.0 110.065 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -98.88 146.68 25.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.148 -0.933 . . . . 25.0 109.593 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -125.29 110.43 14.0 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 104.605 -2.368 . . . . 25.0 104.605 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -107.36 135.73 48.36 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.74 -0.664 . . . . 25.0 111.007 -172.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.6 t -98.93 16.15 23.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.856 0.836 . . . . 25.0 109.183 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -131.23 135.0 47.0 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.415 -0.587 . . . . 25.0 109.415 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -87.72 -11.98 46.63 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.391 0.515 . . . . 25.0 112.391 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 160.72 32.2 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.665 0.617 . . . . 25.0 112.665 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 155.96 39.75 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 116.101 1.889 . . . . 25.0 116.101 -171.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.7 t -102.55 159.24 15.62 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.973 -1.121 . . . . 25.0 107.973 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.3 t -117.9 -14.73 10.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.069 0.396 . . . . 25.0 112.069 172.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.3 t -171.23 153.61 3.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.022 0.439 . . . . 25.0 112.179 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -127.9 139.14 52.78 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 169.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -146.72 152.73 39.29 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.361 -0.977 . . . . 25.0 108.361 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -137.98 135.76 36.3 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.41 -1.7 . . . . 25.0 106.41 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.28 163.36 37.9 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.93 165.77 31.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 113.694 0.998 . . . . 25.0 113.694 -167.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 18.4 p -79.69 162.52 25.16 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 169.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -62.78 159.14 47.03 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.474 -0.784 . . . . 25.0 108.963 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.13 -25.54 31.42 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 116.194 -2.071 . . . . 25.0 113.985 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -113.93 32.03 6.14 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 122.811 0.444 . . . . 25.0 110.736 -175.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.491 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.2 p-90 -71.7 166.62 21.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.958 0.885 . . . . 25.0 112.818 -176.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.87 101.0 10.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.658 -1.155 . . . . 25.0 109.504 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.491 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -91.59 12.95 19.29 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 116.706 2.113 . . . . 25.0 116.706 -168.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.1 t -125.51 12.44 8.07 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.252 -1.018 . . . . 25.0 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.9 mp0 -114.09 157.12 43.02 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.374 -1.285 . . . . 25.0 107.886 -174.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.36 153.16 79.07 Favored 'Trans proline' 0 CA--C 1.533 0.451 0 O-C-N 121.953 0.449 . . . . 25.0 111.59 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 102.56 2.89 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.383 0.611 . . . . 25.0 111.932 -176.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.1 p -89.13 156.54 18.75 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.154 -1.054 . . . . 25.0 108.154 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -65.56 -25.89 67.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.265 0.555 . . . . 25.0 110.85 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.44 60.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.816 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.5 t -78.76 -7.68 58.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.37 0.507 . . . . 25.0 112.37 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 66.1 m-85 -101.63 158.05 16.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.469 1.285 . . . . 25.0 114.469 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -95.72 95.42 8.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 102.655 -3.091 . . . . 25.0 102.655 162.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.1 mt -66.15 -7.58 18.82 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.832 1.419 . . . . 25.0 114.832 -169.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.66 120.25 76.16 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 176.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.52 142.19 43.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.368 -2.621 . . . . 25.0 111.666 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -92.27 -12.31 32.92 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.249 0.462 . . . . 25.0 112.249 -175.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 69.3 m -148.05 64.71 1.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.367 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -88.93 130.97 35.34 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 118.496 -1.282 . . . . 25.0 109.062 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -119.79 99.08 6.42 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 103.689 -2.708 . . . . 25.0 103.689 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -94.02 91.83 7.05 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.6 118.84 37.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 104.424 -2.436 . . . . 25.0 104.424 173.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.35 81.8 0.41 Allowed Glycine 0 CA--C 1.502 -0.758 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.423 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.79 14.81 4.59 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.973 -0.632 . . . . 25.0 113.168 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.86 106.16 5.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.591 0.71 . . . . 25.0 109.691 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.6 123.94 90.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 105.353 -2.092 . . . . 25.0 105.353 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.79 168.87 23.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 N-CA-C 113.765 0.641 . . . . 25.0 113.765 -174.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.82 26.77 4.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.51 -17.05 0.29 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 125.823 1.649 . . . . 25.0 112.188 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.9 mt-30 -128.21 153.13 47.26 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.034 -2.58 . . . . 25.0 104.034 169.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.8 t -142.82 95.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.2 t -94.01 126.64 39.35 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.74 166.99 21.68 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.416 -2.068 . . . . 25.0 105.416 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -130.71 154.39 48.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.581 -2.007 . . . . 25.0 105.581 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.63 160.19 36.24 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.628 -1.249 . . . . 25.0 107.628 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -104.38 116.43 32.12 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.192 0.307 . . . . 25.0 111.346 -176.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.4 mt -77.29 132.4 70.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.121 -1.066 . . . . 25.0 108.121 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -61.14 146.43 97.59 Favored 'Trans proline' 0 C--N 1.354 0.846 0 CA-C-O 121.655 0.606 . . . . 25.0 113.547 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.405 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.85 -26.11 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.197 -0.91 . . . . 25.0 112.802 -168.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.9 p-10 -84.16 9.69 12.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.545 0.688 . . . . 25.0 110.153 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.2 53.39 0.83 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.76 0.791 . . . . 25.0 108.977 172.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -86.04 169.32 13.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.409 -1.33 . . . . 25.0 107.409 175.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.75 -167.72 37.04 Favored Glycine 0 N--CA 1.451 -0.338 0 N-CA-C 115.733 1.053 . . . . 25.0 115.733 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -85.95 107.81 17.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.534 0.683 . . . . 25.0 110.478 -169.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 45.7 p-80 -157.21 171.92 19.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.678 -0.692 . . . . 25.0 110.512 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.9 p -108.03 150.64 10.54 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.125 -1.065 . . . . 25.0 108.125 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.8 mt -132.04 122.7 49.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 104.247 -2.501 . . . . 25.0 104.247 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.6 mp -105.05 127.68 52.99 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.588 -0.733 . . . . 25.0 110.004 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.16 127.59 55.98 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.851 -0.796 . . . . 25.0 108.851 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.63 140.62 46.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 122.075 0.94 . . . . 25.0 112.016 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -117.77 119.4 34.79 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.09 124.18 42.49 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.673 -0.862 . . . . 25.0 108.673 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.9 mm -76.75 141.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.084 -0.71 . . . . 25.0 109.084 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.69 -44.96 22.41 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.192 0.905 . . . . 25.0 110.482 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.14 -21.35 64.93 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -171.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 56.1 p -138.45 169.53 17.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.85 0.833 . . . . 25.0 109.765 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.66 23.2 0.54 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.284 -0.871 . . . . 25.0 112.107 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -94.94 144.12 25.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.36 143.77 16.64 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 104.513 -2.402 . . . . 25.0 104.513 172.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -145.87 134.87 22.62 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.739 0.644 . . . . 25.0 112.739 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.76 113.94 26.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.492 -0.776 . . . . 25.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.02 108.0 20.64 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.04 141.9 31.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.461 -0.79 . . . . 25.0 111.511 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.0 tt -125.37 133.84 68.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.478 -2.045 . . . . 25.0 105.478 167.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -93.7 131.26 39.2 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.1 m -132.59 161.07 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -175.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -117.64 95.02 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 103.67 -2.715 . . . . 25.0 103.67 167.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.57 163.82 14.44 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.027 -0.533 . . . . 25.0 112.29 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.7 p -145.68 163.37 35.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.015 -1.106 . . . . 25.0 108.015 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 CA-C-O 118.085 -0.96 . . . . 25.0 110.821 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 m80 . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 110.294 -0.262 . . . . 25.0 110.294 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 142.78 169.74 12.47 Favored Glycine 0 C--O 1.229 -0.199 0 N-CA-C 103.283 -3.927 . . . . 25.0 103.283 -173.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -146.14 167.87 22.38 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.886 1.843 . . . . 25.0 109.793 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.92 125.11 64.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 107.103 -1.443 . . . . 25.0 107.103 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.93 -42.6 48.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.945 -1.025 . . . . 25.0 109.951 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.3 t -153.59 129.49 5.28 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 105.755 -1.943 . . . . 25.0 105.755 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -64.24 131.95 12.68 Favored 'Cis proline' 0 CA--C 1.533 0.432 0 C-N-CA 128.774 0.739 . . . . 25.0 111.373 -0.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.54 109.96 3.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.016 -0.538 . . . . 25.0 111.477 -173.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -72.0 162.42 29.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.559 -0.534 . . . . 25.0 109.559 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -60.0 -22.28 62.38 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.089 0.471 . . . . 25.0 111.765 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.53 19.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.809 -0.812 . . . . 25.0 108.809 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -64.93 -37.76 88.71 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.659 -0.7 . . . . 25.0 110.411 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -63.06 -32.14 73.44 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.311 -0.243 . . . . 25.0 111.058 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -39.62 92.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.051 0.453 . . . . 25.0 110.325 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.451 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.3 tmtm? -69.84 -34.22 73.35 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.168 0.509 . . . . 25.0 109.975 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -75.16 2.88 9.75 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.374 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.71 10.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.405 1.482 . . . . 25.0 112.778 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.6 mt -86.85 -21.71 26.23 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.335 -1.357 . . . . 25.0 107.335 173.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -122.95 157.35 32.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.337 -2.097 . . . . 25.0 105.337 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.2 p -135.6 176.21 8.88 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.987 -0.375 . . . . 25.0 109.987 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 72.15 5.29 5.27 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.096 1.517 . . . . 25.0 115.096 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -69.13 -39.7 78.71 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 121.734 -0.604 . . . . 25.0 110.908 173.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.99 -63.76 2.0 Favored Glycine 0 C--O 1.217 -0.908 0 N-CA-C 111.831 -0.508 . . . . 25.0 111.831 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.3 p -87.98 -52.98 4.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.466 1.127 . . . . 25.0 111.953 -178.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 29' ' ' PRO . 1.0 OUTLIER -68.2 -11.61 14.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.324 -1.307 . . . . 25.0 112.708 -171.818 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.22 -0.76 57.21 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.918 -0.489 . . . . 25.0 111.896 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -117.12 -35.44 4.07 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.679 -0.809 . . . . 25.0 109.845 172.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -127.04 94.8 38.38 Favored Pre-proline 0 CA--C 1.543 0.68 0 N-CA-C 111.797 0.295 . . . . 25.0 111.797 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.451 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 96.5 Cg_endo -71.83 -19.92 26.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 N-CA-C 115.111 1.158 . . . . 25.0 115.111 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.54 9.3 13.92 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 121.804 -0.56 . . . . 25.0 112.219 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.8 m -67.61 -14.67 63.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.7 m -64.11 131.9 29.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.238 0.829 . . . . 25.0 113.238 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -152.94 149.21 27.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.266 -1.012 . . . . 25.0 108.266 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.71 -168.3 17.83 Favored Glycine 0 N--CA 1.452 -0.233 0 N-CA-C 109.503 -1.439 . . . . 25.0 109.503 -178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.92 149.78 49.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.732 0.766 . . . . 25.0 111.213 -177.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.53 156.89 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.217 -1.401 . . . . 25.0 107.217 171.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.52 -0.14 3.4 Favored Glycine 0 C--N 1.318 -0.462 0 CA-C-N 115.099 -0.955 . . . . 25.0 113.373 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -75.93 146.44 79.24 Favored Pre-proline 0 C--N 1.321 -0.653 0 O-C-N 121.678 -0.895 . . . . 25.0 108.669 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.56 -16.97 16.52 Favored 'Cis proline' 0 CA--C 1.542 0.907 0 N-CA-C 115.834 1.436 . . . . 25.0 115.834 -5.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -74.09 -36.91 64.29 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.343 1.238 . . . . 25.0 114.343 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -111.63 32.86 5.11 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.322 -2.103 . . . . 25.0 105.322 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.29 -177.38 47.31 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.375 -1.284 . . . . 25.0 110.67 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -62.85 172.75 4.41 Favored 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 122.812 2.342 . . . . 25.0 113.784 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.08 30.96 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 106.44 -1.689 . . . . 25.0 106.44 173.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 139.47 58.05 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.489 -1.232 . . . . 25.0 108.072 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.89 -2.82 87.05 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 121.487 -0.387 . . . . 25.0 112.614 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 47.2 m170 -125.82 9.79 7.63 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.277 -0.543 . . . . 25.0 110.348 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.0 mt -66.29 -45.27 90.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 O-C-N 122.028 -0.42 . . . . 25.0 111.04 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.12 -23.43 57.89 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.863 -0.523 . . . . 25.0 109.882 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.0 p -82.83 -7.53 59.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.57 35.19 17.33 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.568 0.747 . . . . 25.0 110.499 -173.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 60.63 36.04 19.75 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -177.816 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -118.71 131.25 56.14 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 122.067 -0.395 . . . . 25.0 110.65 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -61.61 -32.28 72.4 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 113.922 1.082 . . . . 25.0 113.922 -176.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -69.19 -9.98 55.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.821 0.674 . . . . 25.0 112.821 -178.711 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.731 ' HA ' HD13 ' A' ' 59' ' ' LEU . 11.4 m-85 -121.7 16.37 11.09 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.79 -36.19 67.55 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.172 -0.955 . . . . 25.0 110.605 -177.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 mp0 -70.76 -16.63 62.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.088 0.947 . . . . 25.0 108.906 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.731 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -88.85 -2.36 58.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.095 -0.957 . . . . 25.0 108.902 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -112.1 -31.98 6.71 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -96.07 118.17 32.13 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.731 -0.606 . . . . 25.0 110.55 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.458 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.78 161.05 26.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.64 -0.709 . . . . 25.0 109.598 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.1 p -117.2 162.34 28.45 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 100.572 -3.862 . . . . 25.0 100.572 163.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.28 -4.96 14.75 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 116.756 -1.696 . . . . 25.0 115.972 -174.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -127.88 13.63 6.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.81 0.814 . . . . 25.0 111.022 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -77.81 -29.14 50.58 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.37 -0.831 . . . . 25.0 112.55 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.458 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.0 m95 -127.54 168.16 15.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 110.068 -0.345 . . . . 25.0 110.068 -178.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -67.94 120.94 15.03 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 106.6 -1.63 . . . . 25.0 106.6 171.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -95.8 104.76 16.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 100.358 -3.942 . . . . 25.0 100.358 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.83 134.95 53.14 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 114.857 -1.065 . . . . 25.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.05 99.86 12.79 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.56 -1.2 . . . . 25.0 107.925 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.3 mt -131.89 173.92 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 105.759 -1.941 . . . . 25.0 105.759 -176.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -116.51 168.95 9.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.576 0.703 . . . . 25.0 112.57 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.4 p -77.15 173.07 12.26 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 106.365 -1.717 . . . . 25.0 106.365 173.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.07 -162.23 33.64 Favored Glycine 0 C--O 1.241 0.546 0 C-N-CA 120.388 -0.911 . . . . 25.0 111.027 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.97 131.28 40.81 Favored 'Trans proline' 0 C--N 1.345 0.366 0 CA-C-N 118.869 1.334 . . . . 25.0 114.766 -175.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -138.17 161.39 36.95 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.8 p -104.85 152.03 23.11 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -139.31 101.01 4.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.969 -1.863 . . . . 25.0 105.969 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.91 110.16 22.2 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 122.063 0.935 . . . . 25.0 110.54 -178.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -93.96 147.69 22.87 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.28 -0.873 . . . . 25.0 110.113 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -125.34 110.13 13.62 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.741 -2.318 . . . . 25.0 104.741 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.0 mp -102.93 128.74 49.6 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.481 -0.782 . . . . 25.0 110.865 -171.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.8 t -85.58 3.9 38.59 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.105 0.479 . . . . 25.0 111.764 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.8 143.24 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.596 -0.52 . . . . 25.0 109.596 -177.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -84.13 -2.42 56.76 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.983 0.735 . . . . 25.0 112.983 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.97 158.76 24.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.075 0.769 . . . . 25.0 113.075 -176.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.7 t -75.78 155.97 34.98 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.367 1.247 . . . . 25.0 114.367 -172.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.5 t -103.37 155.98 18.08 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.6 -0.727 . . . . 25.0 109.615 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.4 t -117.79 -16.96 9.94 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 111.741 0.275 . . . . 25.0 111.741 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -171.34 154.31 3.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.069 0.461 . . . . 25.0 112.006 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -127.75 142.14 51.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 104.129 -2.545 . . . . 25.0 104.129 168.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -147.42 154.66 41.12 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.121 0.873 . . . . 25.0 108.93 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -137.91 139.01 39.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.888 -1.523 . . . . 25.0 106.888 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -148.9 164.33 34.82 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.573 0.624 . . . . 25.0 110.167 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.11 166.45 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -167.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 p -81.23 164.25 22.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.76 157.06 51.66 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.22 -0.9 . . . . 25.0 109.716 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -68.83 -20.07 39.94 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.891 -0.94 . . . . 25.0 114.535 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -120.96 32.02 6.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.228 0.455 . . . . 25.0 112.228 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.3 p-90 -74.95 164.86 26.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.694 0.759 . . . . 25.0 111.71 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -86.64 100.99 12.84 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.979 -1.01 . . . . 25.0 110.28 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -81.24 23.28 0.6 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 116.12 1.896 . . . . 25.0 116.12 -172.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.6 t -125.84 2.86 7.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.318 0.58 . . . . 25.0 110.482 175.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -108.69 157.02 37.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.329 -0.85 . . . . 25.0 109.477 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.4 153.21 78.13 Favored 'Trans proline' 0 C--N 1.348 0.539 0 O-C-N 121.943 0.444 . . . . 25.0 111.587 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 104.83 3.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.441 0.638 . . . . 25.0 112.313 -175.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.8 p -95.25 156.8 16.17 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 176.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -67.4 -25.17 65.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.3 0.571 . . . . 25.0 110.635 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.17 -25.13 63.29 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.277 -0.874 . . . . 25.0 111.858 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.4 t -85.05 -5.11 59.36 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.954 0.407 . . . . 25.0 111.807 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -103.11 153.83 19.91 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 114.993 1.479 . . . . 25.0 114.993 -174.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.35 90.02 4.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 102.604 -3.11 . . . . 25.0 102.604 163.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.0 -6.39 12.61 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.934 1.457 . . . . 25.0 114.934 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.2 t -80.13 132.68 59.17 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.165 -0.68 . . . . 25.0 109.165 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.8 149.8 48.72 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 114.94 -2.907 . . . . 25.0 110.82 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -102.63 -9.84 19.76 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.969 0.414 . . . . 25.0 111.425 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 54.5 m -150.36 67.89 0.97 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.451 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -89.02 132.88 34.55 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 118.87 -1.132 . . . . 25.0 108.788 175.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -121.68 99.06 6.25 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 104.166 -2.531 . . . . 25.0 104.166 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -89.65 92.11 8.94 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.134 -1.062 . . . . 25.0 108.134 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -109.17 118.28 36.33 Favored 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 107.428 -1.323 . . . . 25.0 107.428 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.69 80.87 0.42 Allowed Glycine 0 CA--C 1.501 -0.795 0 CA-C-N 115.568 -0.742 . . . . 25.0 112.963 -170.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.6 16.94 6.74 Favored Glycine 0 C--N 1.321 -0.289 0 C-N-CA 120.793 -0.717 . . . . 25.0 114.296 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.15 104.88 3.2 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.2 mt -68.68 122.33 84.37 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.27 170.54 19.34 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 117.748 -1.035 . . . . 25.0 113.694 -175.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.84 29.09 6.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.356 -0.979 . . . . 25.0 108.356 176.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.16 -15.67 0.33 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.693 1.597 . . . . 25.0 112.152 -174.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.424 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.1 mt-30 -128.59 152.47 48.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 103.598 -2.742 . . . . 25.0 103.598 170.055 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.3 t -141.38 95.11 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 107.013 -1.477 . . . . 25.0 107.013 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -84.92 134.72 34.25 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 105.514 -2.032 . . . . 25.0 105.514 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.47 165.77 26.35 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 105.626 -1.99 . . . . 25.0 105.626 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -135.5 152.22 51.12 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 104.705 -2.331 . . . . 25.0 104.705 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.87 160.24 30.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.38 -1.341 . . . . 25.0 107.38 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -103.44 118.87 37.74 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.111 0.257 . . . . 25.0 110.924 -177.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.0 mt -76.87 132.57 71.11 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.06 146.25 96.25 Favored 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-O 121.818 0.674 . . . . 25.0 113.456 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.75 -25.18 44.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.991 -1.004 . . . . 25.0 112.721 -169.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -84.48 7.98 18.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.682 -0.69 . . . . 25.0 110.119 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.6 mmt-85 -115.64 55.12 0.79 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 108.41 -0.959 . . . . 25.0 108.41 172.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.6 p -86.02 170.99 11.76 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.176 -1.787 . . . . 25.0 106.176 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.09 -169.53 44.15 Favored Glycine 0 C--N 1.32 -0.311 0 N-CA-C 115.64 1.016 . . . . 25.0 115.64 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.9 t -86.06 113.6 22.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.314 0.578 . . . . 25.0 110.86 -169.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.476 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 52.4 p-80 -159.92 171.78 18.79 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.956 -0.566 . . . . 25.0 111.049 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.6 p -105.01 151.16 7.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.348 -1.353 . . . . 25.0 107.348 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -134.63 128.33 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 102.475 -3.157 . . . . 25.0 102.475 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.8 mp -113.12 131.74 55.72 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 116.067 -0.515 . . . . 25.0 109.659 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.73 131.22 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 25.0 109.565 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -127.55 142.91 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 122.064 0.935 . . . . 25.0 112.525 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -115.57 119.66 36.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.84 -1.527 . . . . 25.0 107.104 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.91 121.89 39.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.086 -1.079 . . . . 25.0 108.086 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 13.1 mm -77.66 143.2 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.002 -0.74 . . . . 25.0 109.002 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.63 -42.9 27.56 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.971 0.805 . . . . 25.0 109.792 175.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.01 -23.7 65.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 114.075 1.139 . . . . 25.0 114.075 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 45.4 p -139.02 168.82 18.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.967 0.889 . . . . 25.0 110.374 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.4 18.7 1.09 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.181 -0.918 . . . . 25.0 112.246 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -90.06 146.59 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.71 138.6 10.83 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.797 -1.927 . . . . 25.0 105.797 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -138.79 132.97 31.49 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.126 0.421 . . . . 25.0 112.032 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -93.18 115.03 27.67 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.653 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -97.05 112.63 24.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.204 -0.665 . . . . 25.0 109.204 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.1 139.12 37.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.915 -0.584 . . . . 25.0 112.163 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -126.45 135.24 64.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.327 -2.101 . . . . 25.0 105.327 166.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -93.67 132.67 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.614 -1.254 . . . . 25.0 107.614 176.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -133.23 161.69 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.539 0.57 . . . . 25.0 112.539 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -120.98 95.04 4.54 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.784 -2.302 . . . . 25.0 104.784 170.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.7 tp -93.53 160.0 14.98 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 114.157 1.169 . . . . 25.0 114.157 -170.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.3 p -145.9 173.03 12.5 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.567 -0.531 . . . . 25.0 109.567 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.74 0 N-CA-C 108.609 -0.886 . . . . 25.0 108.609 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 15.8 m170 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 121.304 0.573 . . . . 25.0 110.752 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.65 167.52 35.38 Favored Glycine 0 C--N 1.322 -0.218 1 N-CA-C 102.147 -4.381 . . . . 25.0 102.147 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -146.1 166.49 25.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 120.071 1.936 . . . . 25.0 109.915 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.89 124.03 63.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.814 -1.18 . . . . 25.0 107.814 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -40.53 56.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.767 -1.106 . . . . 25.0 110.384 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -153.28 128.21 4.81 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -65.55 134.59 21.38 Favored 'Cis proline' 0 C--N 1.347 0.482 0 CA-C-N 118.814 0.612 . . . . 25.0 110.88 -0.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.09 4.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.105 -0.498 . . . . 25.0 111.079 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.7 p -72.13 164.41 26.23 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -59.55 -22.46 61.73 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.183 0.516 . . . . 25.0 111.777 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.71 -52.93 25.55 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.05 -0.722 . . . . 25.0 109.05 175.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -67.37 -35.07 78.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.019 -0.537 . . . . 25.0 110.928 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -63.97 -32.15 73.58 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.061 -0.4 . . . . 25.0 110.739 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -40.48 96.44 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.418 0.628 . . . . 25.0 109.496 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.58 -34.31 76.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.022 -0.535 . . . . 25.0 110.362 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.5 mt -79.78 5.3 13.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.575 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.49 23.02 10.28 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.029 1.331 . . . . 25.0 113.233 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.18 -21.03 24.8 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.741 -1.207 . . . . 25.0 107.741 174.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -123.62 159.53 29.07 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 105.148 -2.168 . . . . 25.0 105.148 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.4 p -135.16 175.64 9.4 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 122.215 0.206 . . . . 25.0 110.517 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 71.46 5.06 5.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.75 1.759 . . . . 25.0 115.75 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -68.26 -38.95 82.28 Favored 'General case' 0 CA--C 1.501 -0.92 0 O-C-N 121.53 -0.731 . . . . 25.0 111.392 175.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.95 -64.21 1.57 Allowed Glycine 0 C--O 1.218 -0.869 0 O-C-N 123.575 0.547 . . . . 25.0 112.087 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -87.98 -53.29 4.81 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.581 1.181 . . . . 25.0 111.599 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.13 -7.97 9.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.017 -172.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.83 2.74 53.11 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.825 -0.547 . . . . 25.0 111.527 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -119.72 -33.98 3.88 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.949 -0.7 . . . . 25.0 109.98 172.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -126.98 103.9 23.34 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 110.102 -0.333 . . . . 25.0 110.102 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.98 -21.11 21.2 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.034 -1.511 . . . . 25.0 114.678 -175.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.99 12.89 6.72 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.0 m -66.79 -13.77 61.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.829 0.307 . . . . 25.0 111.829 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 27.8 m -65.72 135.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 113.654 0.983 . . . . 25.0 113.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -153.06 151.55 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -157.92 -172.08 24.65 Favored Glycine 0 C--N 1.328 0.115 0 N-CA-C 110.575 -1.01 . . . . 25.0 110.575 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 tp -127.62 148.29 50.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.011 0.906 . . . . 25.0 112.011 -177.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.63 156.97 33.69 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.008 -1.108 . . . . 25.0 108.008 172.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 134.85 2.36 3.14 Favored Glycine 0 C--O 1.224 -0.489 0 CA-C-N 114.832 -1.076 . . . . 25.0 113.285 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -75.78 141.44 72.06 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 121.536 -0.979 . . . . 25.0 109.757 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -92.07 -18.37 12.98 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 N-CA-C 115.899 1.461 . . . . 25.0 115.899 -5.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -73.13 -35.19 66.47 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.043 1.497 . . . . 25.0 115.043 -168.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.93 38.23 3.72 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.16 -2.163 . . . . 25.0 105.16 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -111.9 -171.77 18.93 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 114.345 -1.298 . . . . 25.0 110.444 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.74 167.27 10.43 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.19 1.926 . . . . 25.0 114.739 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.02 159.97 31.09 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.727 -1.583 . . . . 25.0 106.727 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.11 139.24 57.62 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.287 -1.324 . . . . 25.0 108.914 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.49 -2.91 84.27 Favored Glycine 0 C--O 1.225 -0.415 0 CA-C-N 116.038 -0.528 . . . . 25.0 112.806 -175.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -124.5 11.73 8.63 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.473 -0.936 . . . . 25.0 108.473 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 59.5 mt -65.21 -54.35 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 112.61 0.596 . . . . 25.0 112.61 -171.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.26 -20.17 60.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.874 0.845 . . . . 25.0 108.798 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 t -74.56 -16.26 60.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.962 . . . . 25.0 111.792 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 55.26 26.24 8.3 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.38 0.672 . . . . 25.0 109.94 -172.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.57 35.78 22.66 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.781 1.232 . . . . 25.0 114.106 -176.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -122.3 133.97 54.67 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.183 0.593 . . . . 25.0 111.051 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -59.87 -31.96 70.26 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 115.092 1.515 . . . . 25.0 115.092 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.6 OUTLIER -70.09 -10.25 58.13 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.191 0.441 . . . . 25.0 112.191 -179.249 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.676 ' HA ' HD13 ' A' ' 59' ' ' LEU . 8.4 m-85 -123.63 16.23 9.54 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -71.12 -41.59 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.058 -1.026 . . . . 25.0 111.613 -174.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -73.43 -11.09 60.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.717 0.77 . . . . 25.0 109.722 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.676 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.9 mp -84.26 -6.61 59.42 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -114.83 -34.96 4.95 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.638 0.607 . . . . 25.0 112.638 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -89.42 113.5 24.85 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.651 -0.656 . . . . 25.0 111.094 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.0 pm0 -121.92 160.99 23.64 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.661 -0.7 . . . . 25.0 109.376 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -119.97 163.88 25.49 Favored Pre-proline 0 C--N 1.317 -0.825 1 N-CA-C 99.95 -4.093 . . . . 25.0 99.95 162.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.92 -5.78 17.11 Favored 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 116.196 -2.069 . . . . 25.0 115.669 -175.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -121.41 9.78 10.39 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.712 0.768 . . . . 25.0 111.115 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -77.78 -28.72 50.61 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.39 -0.819 . . . . 25.0 113.013 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 13.0 m95 -127.21 167.61 15.84 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.87 0.367 . . . . 25.0 111.717 -177.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -67.75 119.12 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 106.124 -1.806 . . . . 25.0 106.124 167.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -92.54 104.25 16.57 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 100.934 -3.728 . . . . 25.0 100.934 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.75 135.34 54.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.589 -1.187 . . . . 25.0 110.165 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -93.33 102.2 14.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.733 -1.121 . . . . 25.0 108.187 -177.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.6 mt -130.01 173.99 10.2 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.001 -1.111 . . . . 25.0 108.001 -176.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.46 156.89 26.05 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.55 -0.75 . . . . 25.0 111.562 -175.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.472 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.1 p -77.17 166.26 23.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.95 -1.5 . . . . 25.0 106.95 173.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.03 -164.5 21.57 Favored Glycine 0 C--O 1.239 0.454 0 N-CA-C 110.677 -0.969 . . . . 25.0 110.677 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.38 134.2 59.83 Favored 'Trans proline' 0 C--N 1.346 0.417 0 CA-C-N 118.972 1.386 . . . . 25.0 114.278 -177.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -140.84 161.66 37.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.309 -1.738 . . . . 25.0 106.309 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.2 p -105.4 152.12 23.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.837 -1.172 . . . . 25.0 107.837 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -139.45 101.02 4.13 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 105.967 -1.864 . . . . 25.0 105.967 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.39 108.77 20.15 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.79 0.805 . . . . 25.0 110.341 -178.149 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -97.75 148.67 23.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.602 -0.726 . . . . 25.0 110.094 -178.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -127.25 116.33 20.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 104.205 -2.517 . . . . 25.0 104.205 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -112.26 119.22 37.59 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.455 -0.793 . . . . 25.0 110.573 -173.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.01 18.58 3.48 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.507 0.67 . . . . 25.0 110.999 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.11 138.23 36.86 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.509 -0.552 . . . . 25.0 109.509 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -86.07 -7.15 58.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.488 0.922 . . . . 25.0 113.488 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.57 154.49 32.48 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.457 0.54 . . . . 25.0 112.457 -176.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.9 t -72.7 155.94 39.47 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -173.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.418 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.7 t -97.97 158.35 15.59 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 173.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.7 -14.98 10.17 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.041 0.213 . . . . 25.0 111.182 171.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -173.28 153.3 2.4 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.866 0.365 . . . . 25.0 111.826 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.07 139.08 54.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.225 -2.509 . . . . 25.0 104.225 166.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -143.08 148.18 36.24 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -137.92 132.36 32.29 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -149.52 164.01 36.25 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.65 0.659 . . . . 25.0 110.517 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.29 164.12 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -167.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.6 p -77.89 163.5 25.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.18 155.15 47.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.221 -0.899 . . . . 25.0 109.703 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -68.87 -23.01 35.56 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 117.404 -1.264 . . . . 25.0 113.633 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -113.09 32.07 5.99 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.607 0.363 . . . . 25.0 111.476 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 3.8 p-90 -82.28 163.06 22.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.674 0.75 . . . . 25.0 111.044 -177.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -93.28 100.98 13.23 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.096 -0.956 . . . . 25.0 110.574 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.484 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -74.01 19.92 0.11 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.817 1.784 . . . . 25.0 115.817 -175.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -112.52 -6.28 13.97 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 174.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -100.25 157.09 34.45 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.449 -0.796 . . . . 25.0 109.286 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 159.08 54.03 Favored 'Trans proline' 0 C--N 1.346 0.426 0 O-C-N 121.962 0.453 . . . . 25.0 112.241 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.98 99.95 1.89 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.076 0.465 . . . . 25.0 111.115 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.6 p -99.14 154.65 17.97 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.604 -0.887 . . . . 25.0 108.604 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -65.59 -25.62 67.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.255 0.55 . . . . 25.0 110.635 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.18 -25.19 63.31 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 25.0 111.973 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 30.8 t -89.6 -3.1 58.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.819 0.343 . . . . 25.0 111.597 -178.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -101.09 152.38 20.68 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.903 1.075 . . . . 25.0 113.903 -175.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -100.16 95.23 6.68 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 103.108 -2.923 . . . . 25.0 103.108 164.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -67.65 -6.4 20.32 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.195 1.183 . . . . 25.0 114.195 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.16 125.36 85.22 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 109.12 -0.696 . . . . 25.0 109.12 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -72.86 148.57 46.14 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 115.14 -2.773 . . . . 25.0 111.554 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -100.64 -14.77 18.0 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.5 m -147.35 64.42 1.15 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.568 -0.287 . . . . 25.0 111.101 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -89.08 138.59 31.28 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.457 -1.297 . . . . 25.0 108.825 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.59 99.54 6.05 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 103.552 -2.759 . . . . 25.0 103.552 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -92.09 91.87 8.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.692 -1.225 . . . . 25.0 107.692 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -110.25 118.03 35.26 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.67 80.46 0.46 Allowed Glycine 0 CA--C 1.502 -0.744 0 CA-C-N 115.459 -0.791 . . . . 25.0 113.791 -169.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.34 18.9 6.02 Favored Glycine 0 C--N 1.321 -0.263 0 C-N-CA 120.941 -0.647 . . . . 25.0 113.443 178.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.86 106.89 6.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.614 0.721 . . . . 25.0 109.427 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.1 mt -70.73 122.7 87.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 105.834 -1.913 . . . . 25.0 105.834 176.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.5 169.24 21.39 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 118.125 -0.783 . . . . 25.0 113.94 -174.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.0 22.54 6.46 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.852 -0.613 . . . . 25.0 109.542 176.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.55 -17.46 0.28 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 125.716 1.607 . . . . 25.0 112.739 -176.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -128.96 150.06 50.55 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 103.172 -2.899 . . . . 25.0 103.172 168.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.9 t -140.33 94.99 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 38.1 m -89.64 121.5 31.88 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 174.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -132.33 166.95 20.76 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.63 -1.248 . . . . 25.0 107.63 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -132.83 155.73 48.45 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.432 -1.692 . . . . 25.0 106.432 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.48 160.53 23.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 47.7 m-20 -103.94 119.69 39.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.466 0.174 . . . . 25.0 110.57 -177.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.1 mt -76.69 131.06 74.69 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 107.117 -1.438 . . . . 25.0 107.117 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.65 145.92 91.88 Favored 'Trans proline' 0 C--N 1.352 0.751 0 CA-C-O 121.668 0.612 . . . . 25.0 113.384 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.83 -26.48 40.45 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.316 -0.856 . . . . 25.0 112.625 -169.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -82.38 7.11 14.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.6 -0.727 . . . . 25.0 110.275 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -118.59 51.82 1.07 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.268 -1.012 . . . . 25.0 108.268 172.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 9.3 p -85.89 170.99 11.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 106.086 -1.82 . . . . 25.0 106.086 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.01 -171.34 37.2 Favored Glycine 0 N--CA 1.452 -0.259 0 N-CA-C 115.444 0.937 . . . . 25.0 115.444 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.2 t -86.05 109.68 18.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.391 0.615 . . . . 25.0 110.512 -169.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.443 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.3 p-80 -158.26 171.06 20.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.974 -0.557 . . . . 25.0 111.941 -175.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.6 p -104.2 150.58 7.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.1 mt -133.25 121.92 43.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.6 132.91 52.06 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.608 -0.724 . . . . 25.0 109.78 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.25 135.23 53.27 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.193 -0.669 . . . . 25.0 109.193 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.98 144.6 37.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.922 0.868 . . . . 25.0 112.531 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.418 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 13.3 t90 -113.28 112.37 23.6 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.121 -1.807 . . . . 25.0 106.121 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -92.62 125.23 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.0 mm -81.46 141.53 15.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 109.578 -0.527 . . . . 25.0 109.578 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.46 -43.05 24.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.868 0.758 . . . . 25.0 110.409 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -23.92 64.69 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.611 0.967 . . . . 25.0 113.611 -172.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.4 p -138.86 169.99 16.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.912 0.863 . . . . 25.0 109.91 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.05 20.32 0.81 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.223 -0.899 . . . . 25.0 112.189 178.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -90.01 145.9 24.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.592 -0.693 . . . . 25.0 112.731 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.66 136.81 7.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.343 -1.725 . . . . 25.0 106.343 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -137.87 130.33 29.39 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.482 0.549 . . . . 25.0 112.482 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.07 117.59 28.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.65 -0.704 . . . . 25.0 110.605 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -97.13 115.91 28.39 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.801 -1.185 . . . . 25.0 107.801 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.95 142.97 27.59 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.8 136.7 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 104.505 -2.405 . . . . 25.0 104.505 166.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -99.47 129.83 45.68 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.0 m -133.5 162.19 40.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -116.03 95.05 4.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.912 -2.625 . . . . 25.0 103.912 166.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.77 163.09 14.59 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.104 -0.498 . . . . 25.0 112.164 -172.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.6 p -145.98 162.68 37.29 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.847 -0.797 . . . . 25.0 108.847 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.751 0 CA-C-O 118.005 -0.998 . . . . 25.0 111.05 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 m170 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.258 0.552 . . . . 25.0 110.967 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.54 169.98 40.01 Favored Glycine 0 CA--C 1.509 -0.333 1 N-CA-C 102.839 -4.104 . . . . 25.0 102.839 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -145.13 167.28 23.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.891 1.845 . . . . 25.0 109.3 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.75 124.67 64.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.477 -0.935 . . . . 25.0 108.477 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -75.2 -43.5 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.661 -1.154 . . . . 25.0 109.96 -175.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.5 t -152.74 129.27 5.43 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 105.798 -1.927 . . . . 25.0 105.798 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -64.77 132.87 15.45 Favored 'Cis proline' 0 C--N 1.346 0.4 0 CA-C-N 118.791 0.604 . . . . 25.0 110.895 -0.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 109.67 2.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.039 -0.528 . . . . 25.0 111.953 -172.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 t -72.01 157.71 37.32 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -55.25 -25.25 32.46 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.562 0.745 . . . . 25.0 111.828 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.16 -53.52 36.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.659 0.742 . . . . 25.0 109.431 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -67.75 -35.04 78.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.714 -0.675 . . . . 25.0 110.626 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -63.56 -32.35 73.79 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 122.076 -0.39 . . . . 25.0 110.344 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -39.06 92.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 25.0 110.031 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.73 -35.81 79.43 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.058 -0.519 . . . . 25.0 109.821 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.7 mt -77.91 3.54 14.27 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.179 -0.464 . . . . 25.0 111.623 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 57.92 21.98 8.24 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.242 1.417 . . . . 25.0 113.245 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.6 mt -84.05 -21.37 31.6 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -123.78 158.59 31.41 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.812 -2.292 . . . . 25.0 104.812 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.6 p -136.6 176.02 9.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.918 -0.401 . . . . 25.0 109.918 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 71.97 5.21 5.28 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.516 1.672 . . . . 25.0 115.516 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 78.6 m -68.54 -36.7 79.17 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 121.585 -0.697 . . . . 25.0 111.154 174.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -62.96 1.45 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.681 0.613 . . . . 25.0 112.378 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.3 t -87.97 -53.74 4.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 122.564 1.173 . . . . 25.0 111.868 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.2 t -67.36 -12.37 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.41 -1.268 . . . . 25.0 113.116 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.4 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 14.0 pt20 -87.02 -2.26 58.5 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 121.808 -0.557 . . . . 25.0 111.75 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -117.26 -34.53 4.31 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 119.744 -0.782 . . . . 25.0 110.424 172.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -127.04 98.52 30.21 Favored Pre-proline 0 C--O 1.24 0.597 0 N-CA-C 110.414 -0.217 . . . . 25.0 110.414 170.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.83 -20.68 22.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 116.976 -1.549 . . . . 25.0 114.734 -174.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -82.88 8.83 11.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.845 -0.534 . . . . 25.0 112.384 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m -67.68 -14.65 63.12 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.553 0.575 . . . . 25.0 112.553 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 m -64.16 133.05 30.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 121.703 0.763 . . . . 25.0 112.56 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -153.0 156.06 38.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 105.922 -1.881 . . . . 25.0 105.922 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.17 -169.04 23.89 Favored Glycine 0 N--CA 1.453 -0.167 0 N-CA-C 108.98 -1.648 . . . . 25.0 108.98 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -128.2 148.65 50.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.148 0.974 . . . . 25.0 111.474 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.82 157.05 31.44 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 107.473 -1.306 . . . . 25.0 107.473 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -3.47 2.19 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.751 -1.113 . . . . 25.0 112.484 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -75.89 145.5 77.88 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 108.397 -0.964 . . . . 25.0 108.397 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.75 -19.16 12.07 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 N-CA-C 116.255 1.598 . . . . 25.0 116.255 -4.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -76.61 -35.26 58.18 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.724 1.379 . . . . 25.0 114.724 -169.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.0 30.35 7.11 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.58 -176.22 43.01 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.349 -1.296 . . . . 25.0 110.978 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -62.24 171.15 5.54 Favored 'Trans proline' 0 C--O 1.241 0.626 0 C-N-CA 122.796 2.331 . . . . 25.0 113.934 178.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 159.97 30.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 106.859 -1.534 . . . . 25.0 106.859 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.77 138.17 58.13 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 107.192 -1.41 . . . . 25.0 107.192 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.39 85.67 Favored Glycine 0 C--O 1.229 -0.21 0 C-N-CA 121.468 -0.396 . . . . 25.0 112.962 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -124.92 10.9 8.29 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.742 -0.466 . . . . 25.0 109.742 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 63.3 mt -64.95 -49.15 81.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 122.217 -0.302 . . . . 25.0 111.486 -173.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.24 -21.22 56.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.073 0.463 . . . . 25.0 109.898 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.7 p -83.46 -8.65 59.33 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.569 0.581 . . . . 25.0 112.569 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.63 32.6 12.09 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.556 0.742 . . . . 25.0 110.176 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.34 38.28 25.89 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.727 1.38 . . . . 25.0 114.727 -176.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.54 137.02 54.61 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.023 0.529 . . . . 25.0 110.942 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.41 -35.78 80.3 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 115.135 1.532 . . . . 25.0 115.135 -174.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -70.95 -7.18 44.16 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.529 0.566 . . . . 25.0 112.529 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.5 m-85 -121.47 11.96 10.74 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -72.55 -35.25 67.97 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.891 -1.131 . . . . 25.0 110.218 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.9 mp0 -70.83 -16.05 62.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.889 0.852 . . . . 25.0 109.576 174.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.82 -3.8 58.91 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.789 -0.819 . . . . 25.0 108.789 -177.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -115.1 -32.13 5.81 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.293 0.479 . . . . 25.0 112.293 173.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -91.64 118.08 30.31 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 121.496 -0.752 . . . . 25.0 109.854 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.451 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.9 pm0 -124.06 161.0 26.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.921 -0.581 . . . . 25.0 110.13 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -120.0 162.71 31.97 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 100.25 -3.981 . . . . 25.0 100.25 163.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.06 -7.17 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.775 -1.683 . . . . 25.0 115.786 -175.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -125.18 10.73 8.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.225 0.536 . . . . 25.0 112.018 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -77.32 -28.47 53.19 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.723 -0.61 . . . . 25.0 112.551 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 12.3 m95 -125.11 165.85 17.47 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 120.656 0.265 . . . . 25.0 110.814 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -68.83 120.97 15.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.97 -1.863 . . . . 25.0 105.97 170.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -94.48 103.87 15.83 Favored 'General case' 0 CA--C 1.499 -1.007 1 N-CA-C 99.997 -4.075 . . . . 25.0 99.997 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -66.19 134.58 53.02 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.024 -0.989 . . . . 25.0 110.512 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.83 99.42 12.29 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.715 -1.217 . . . . 25.0 107.715 -178.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.2 mt -130.9 173.94 10.47 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.275 -1.75 . . . . 25.0 106.275 -176.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -113.4 163.73 14.5 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.786 1.032 . . . . 25.0 113.786 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.487 HG22 HD23 ' A' ' 168' ' ' LEU . 77.9 p -77.05 170.81 15.86 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.745 -1.57 . . . . 25.0 106.953 175.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.09 -161.72 29.32 Favored Glycine 0 C--O 1.241 0.581 0 N-CA-C 111.144 -0.782 . . . . 25.0 111.144 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.68 131.34 41.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 118.935 1.368 . . . . 25.0 114.132 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -138.01 160.48 39.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.342 -1.725 . . . . 25.0 106.342 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.3 p -99.39 150.35 22.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.527 -1.286 . . . . 25.0 107.527 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -137.61 100.98 4.35 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 105.54 -2.022 . . . . 25.0 105.54 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.68 112.57 25.33 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.367 -0.833 . . . . 25.0 109.988 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.3 m95 -101.7 151.65 21.78 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 25.0 110.051 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -128.61 114.33 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 104.89 -2.263 . . . . 25.0 104.89 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -116.8 117.98 31.26 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.8 0.84 . . . . 25.0 112.085 -173.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.72 -32.71 69.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.454 0.645 . . . . 25.0 109.828 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.96 106.08 17.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 25.0 110.704 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -70.09 -0.12 7.11 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 115.161 1.541 . . . . 25.0 115.161 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.34 158.32 36.55 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.607 0.241 . . . . 25.0 111.613 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.2 t -67.79 156.09 37.82 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 116.053 1.872 . . . . 25.0 116.053 -170.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.437 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.5 t -99.1 161.05 13.84 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 114.856 -1.066 . . . . 25.0 108.241 172.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 t -117.97 -15.48 9.95 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.114 0.259 . . . . 25.0 111.081 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 t -172.81 155.39 3.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.965 0.412 . . . . 25.0 111.793 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 57.6 m95 -126.67 137.44 53.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 105.137 -2.171 . . . . 25.0 105.137 166.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -139.87 146.15 38.94 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.447 -0.945 . . . . 25.0 108.447 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -137.47 133.7 34.94 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.543 -1.651 . . . . 25.0 106.543 -176.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.99 161.49 42.23 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.557 0.617 . . . . 25.0 110.562 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.4 163.13 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 114.145 1.165 . . . . 25.0 114.145 -168.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.1 p -77.71 159.85 28.83 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.216 -1.031 . . . . 25.0 108.216 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -62.74 157.66 57.29 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.909 -1.042 . . . . 25.0 109.575 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -69.59 -18.24 37.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 N-CA-C 114.861 1.062 . . . . 25.0 114.861 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -118.73 31.85 6.44 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.615 0.366 . . . . 25.0 111.985 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -76.72 163.17 27.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.723 0.773 . . . . 25.0 111.5 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -85.95 101.31 12.78 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.899 -1.046 . . . . 25.0 110.297 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.82 21.67 0.66 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 116.059 1.874 . . . . 25.0 116.059 -173.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.0 t -125.36 0.42 7.69 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.475 0.655 . . . . 25.0 109.669 173.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -103.61 158.81 31.08 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.478 -0.934 . . . . 25.0 108.478 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.62 156.01 67.69 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 121.863 0.401 . . . . 25.0 112.66 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.76 100.87 1.58 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.964 0.412 . . . . 25.0 111.817 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 57.8 p -94.14 152.66 18.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -66.21 -25.17 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.342 0.592 . . . . 25.0 110.804 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.76 -24.61 63.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.348 -0.842 . . . . 25.0 112.093 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.9 t -83.35 -5.24 59.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.709 0.29 . . . . 25.0 111.777 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -102.94 154.02 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.344 1.238 . . . . 25.0 114.344 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -95.33 96.46 9.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 103.167 -2.901 . . . . 25.0 103.167 164.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.1 mt -69.01 -6.67 29.38 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -171.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.46 123.0 83.15 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 108.57 -0.9 . . . . 25.0 108.57 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 139.54 35.07 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 115.059 -2.827 . . . . 25.0 112.148 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -92.2 -12.51 32.56 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -176.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.3 m -147.58 66.88 1.12 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.317 -0.401 . . . . 25.0 110.071 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.01 135.05 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 118.727 -1.189 . . . . 25.0 108.978 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -125.18 99.39 6.07 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.895 -2.631 . . . . 25.0 103.895 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -91.16 91.91 8.44 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 106.694 -1.595 . . . . 25.0 106.694 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -111.76 116.99 31.62 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.114 0.959 . . . . 25.0 108.568 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.73 81.58 0.43 Allowed Glycine 0 CA--C 1.501 -0.818 0 CA-C-N 115.004 -0.998 . . . . 25.0 112.312 -172.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.14 15.04 4.81 Favored Glycine 0 C--O 1.228 -0.276 0 C-N-CA 120.867 -0.682 . . . . 25.0 114.086 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.01 104.06 5.44 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.266 -1.013 . . . . 25.0 108.266 176.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.4 mt -78.74 122.06 84.29 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 107.62 -1.252 . . . . 25.0 107.62 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.0 160.84 42.32 Favored 'Trans proline' 0 C--N 1.347 0.451 0 CA-C-O 121.505 0.544 . . . . 25.0 113.478 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.98 31.95 3.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.78 -4.58 1.66 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 113.618 -1.628 . . . . 25.0 111.435 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.06 152.33 48.71 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.438 -2.43 . . . . 25.0 104.438 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.5 t -141.39 95.09 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.221 -1.77 . . . . 25.0 106.221 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.8 t -85.43 140.98 30.29 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 104.69 -2.337 . . . . 25.0 104.69 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -156.98 166.91 32.02 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.81 -1.541 . . . . 25.0 108.705 -176.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -134.11 157.57 45.82 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.17 160.49 30.2 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -105.61 115.55 30.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.068 0.23 . . . . 25.0 111.034 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.2 mt -77.38 132.62 69.24 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 108.058 -1.09 . . . . 25.0 108.058 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.69 146.5 96.69 Favored 'Trans proline' 0 C--N 1.353 0.791 0 N-CA-C 113.766 0.641 . . . . 25.0 113.766 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -82.2 -25.78 33.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.164 -0.925 . . . . 25.0 112.768 -170.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -83.83 9.83 11.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.684 0.754 . . . . 25.0 110.115 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.2 mmt-85 -116.31 58.08 0.76 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.221 -1.029 . . . . 25.0 108.221 172.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.2 p -86.0 170.85 11.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 107.551 -1.278 . . . . 25.0 107.551 175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 81.89 -163.25 43.59 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.851 1.101 . . . . 25.0 115.851 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.1 t -85.71 107.45 17.59 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.288 0.566 . . . . 25.0 110.693 -168.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.441 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.1 p-80 -156.29 169.71 23.93 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.018 -0.537 . . . . 25.0 111.32 -177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -107.74 151.27 9.84 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.42 120.8 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.14 -2.17 . . . . 25.0 105.14 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -105.18 138.59 41.15 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.513 -0.767 . . . . 25.0 109.955 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -131.84 140.29 49.09 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.166 -0.679 . . . . 25.0 109.166 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -128.59 140.37 49.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.879 0.847 . . . . 25.0 112.358 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.437 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 16.6 t90 -103.42 113.12 26.37 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.395 -1.705 . . . . 25.0 106.395 173.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -94.48 119.95 33.97 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.4 mm -76.92 142.05 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 O-C-N 122.162 -0.336 . . . . 25.0 110.157 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.72 -44.34 20.96 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.551 0.691 . . . . 25.0 110.177 174.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.07 -24.63 65.08 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.778 1.399 . . . . 25.0 114.778 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.6 p -139.26 170.8 15.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 122.142 0.972 . . . . 25.0 110.648 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 18.79 1.25 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.883 -1.053 . . . . 25.0 112.386 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -89.94 148.87 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.727 -0.608 . . . . 25.0 112.172 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.29 143.0 10.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.619 -1.993 . . . . 25.0 105.619 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -146.83 133.8 20.26 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.192 0.441 . . . . 25.0 112.192 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -92.41 115.87 28.47 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.838 -0.619 . . . . 25.0 111.481 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -97.0 122.77 40.36 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.232 -1.025 . . . . 25.0 108.232 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -98.13 143.61 28.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.291 -0.413 . . . . 25.0 111.771 -177.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -125.72 136.49 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 106.144 -1.799 . . . . 25.0 106.144 167.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -97.06 130.58 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.6 -1.259 . . . . 25.0 107.6 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.74 162.66 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.904 0.705 . . . . 25.0 112.904 -174.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.79 95.07 4.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 104.964 -2.235 . . . . 25.0 104.964 168.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.487 HD23 HG22 ' A' ' 74' ' ' THR . 2.1 tp -92.31 158.83 15.89 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.259 1.207 . . . . 25.0 114.259 -169.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.3 p -145.9 165.35 29.2 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.622 -0.51 . . . . 25.0 109.622 176.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.76 0 CA-C-O 118.745 -0.645 . . . . 25.0 110.29 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.3 m80 . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 121.739 0.78 . . . . 25.0 110.429 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.98 167.24 31.83 Favored Glycine 0 C--N 1.318 -0.449 1 N-CA-C 100.05 -5.22 . . . . 25.0 100.05 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -144.25 158.61 43.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 120.484 2.142 . . . . 25.0 110.732 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.52 118.94 36.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 106.428 -1.693 . . . . 25.0 106.428 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -75.91 -41.25 52.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.166 -1.379 . . . . 25.0 109.608 -174.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 t -153.97 129.01 4.93 Favored Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 105.745 -1.946 . . . . 25.0 105.745 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HB2' HD13 ' A' ' 164' ' ' ILE . 65.3 Cg_endo -64.37 131.54 12.0 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.991 0.83 . . . . 25.0 111.316 -0.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 114.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.975 -0.557 . . . . 25.0 112.396 -172.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.0 t -71.98 158.0 36.8 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -55.78 -24.31 34.94 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.264 0.626 . . . . 25.0 111.822 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.79 -54.12 36.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.82 0.819 . . . . 25.0 109.288 175.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -69.03 -34.49 75.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.398 -0.819 . . . . 25.0 110.741 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.44 -33.35 75.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.98 -0.45 . . . . 25.0 110.517 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -39.9 95.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.243 0.545 . . . . 25.0 109.873 177.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -66.32 -36.5 83.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.222 0.534 . . . . 25.0 110.061 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.4 mt -77.27 4.87 9.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.41 176.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.53 24.11 11.55 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.309 1.444 . . . . 25.0 112.647 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -88.6 -21.38 24.05 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.841 -1.17 . . . . 25.0 107.841 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -122.95 159.21 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 106.613 -1.625 . . . . 25.0 106.613 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.2 p -132.86 175.48 9.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 122.597 0.359 . . . . 25.0 110.221 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 68.44 5.26 4.68 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.813 1.782 . . . . 25.0 115.813 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.7 m -68.16 -41.08 82.07 Favored 'General case' 0 CA--C 1.501 -0.91 0 O-C-N 121.299 -0.876 . . . . 25.0 111.017 173.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.67 -63.84 1.87 Allowed Glycine 0 C--O 1.218 -0.872 0 O-C-N 123.599 0.562 . . . . 25.0 111.93 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.5 t -87.94 -51.82 5.61 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 122.291 1.043 . . . . 25.0 112.043 -177.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.7 OUTLIER -66.97 -13.25 16.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 114.867 -1.06 . . . . 25.0 113.141 -172.168 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.86 -4.1 58.41 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.735 -0.603 . . . . 25.0 111.514 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -115.01 -34.03 5.21 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.419 -0.513 . . . . 25.0 110.322 174.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -126.95 95.57 36.73 Favored Pre-proline 0 C--O 1.243 0.754 0 CA-C-O 120.664 0.269 . . . . 25.0 110.412 171.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' VAL . 95.7 Cg_endo -72.51 -19.44 24.84 Favored 'Trans proline' 0 C--N 1.346 0.413 0 N-CA-C 115.097 1.153 . . . . 25.0 115.097 -174.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -91.34 14.14 15.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -176.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -62.89 -18.7 63.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.15 -0.477 . . . . 25.0 112.233 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.7 m -64.08 116.55 3.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 115.191 1.552 . . . . 25.0 115.191 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -153.09 157.44 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.15 -169.24 22.25 Favored Glycine 0 C--O 1.229 -0.168 0 N-CA-C 108.054 -2.018 . . . . 25.0 108.054 -177.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 tp -112.3 147.43 36.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.493 1.147 . . . . 25.0 112.301 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.76 156.97 31.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.676 -1.231 . . . . 25.0 107.676 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.92 -1.72 2.88 Favored Glycine 0 C--O 1.224 -0.501 0 CA-C-N 114.706 -1.134 . . . . 25.0 112.351 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -75.91 144.82 76.76 Favored Pre-proline 0 C--N 1.321 -0.649 0 O-C-N 121.664 -0.904 . . . . 25.0 110.073 -176.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -91.39 -18.07 14.67 Favored 'Cis proline' 0 CA--C 1.542 0.9 0 N-CA-C 115.585 1.34 . . . . 25.0 115.585 -6.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.46 -36.3 60.7 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.124 1.528 . . . . 25.0 115.124 -168.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.61 40.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.35 -167.58 16.69 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.219 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -59.79 168.27 5.84 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 123.1 2.533 . . . . 25.0 114.052 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.03 31.02 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.872 -1.529 . . . . 25.0 106.872 173.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -57.93 140.81 51.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.784 -1.098 . . . . 25.0 108.443 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.94 -4.05 81.68 Favored Glycine 0 C--O 1.225 -0.41 0 CA-C-N 116.012 -0.54 . . . . 25.0 113.091 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -124.25 10.33 8.66 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.456 -0.942 . . . . 25.0 108.456 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.6 mt -68.45 -51.27 48.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 122.311 -0.243 . . . . 25.0 111.25 -173.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.49 -20.23 60.73 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.886 -0.509 . . . . 25.0 109.772 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 p -84.21 -10.34 57.79 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.388 0.514 . . . . 25.0 112.388 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.42 36.15 15.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.631 0.772 . . . . 25.0 110.136 -171.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.4 t0 61.03 34.01 19.43 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.834 1.42 . . . . 25.0 114.834 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -119.26 135.2 54.81 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.952 -0.468 . . . . 25.0 111.658 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.8 p -61.05 -35.93 78.24 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -72.15 -7.27 48.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.239 0.542 . . . . 25.0 112.408 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.681 ' HA ' HD13 ' A' ' 59' ' ' LEU . 15.2 m-85 -120.39 12.26 11.63 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 107.024 -1.473 . . . . 25.0 107.024 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -72.23 -34.67 68.48 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.151 -0.968 . . . . 25.0 110.117 -175.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -70.09 -17.3 63.21 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 122.023 0.916 . . . . 25.0 110.011 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.2 -4.98 59.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.632 -0.877 . . . . 25.0 108.632 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -113.17 -32.06 6.43 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.096 0.474 . . . . 25.0 111.783 173.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -93.89 115.58 27.97 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.721 -0.612 . . . . 25.0 110.388 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.438 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -126.6 161.0 29.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.163 0.506 . . . . 25.0 109.792 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -118.2 161.99 32.14 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 100.45 -3.907 . . . . 25.0 100.45 162.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.02 -1.65 9.04 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 116.983 -1.545 . . . . 25.0 115.852 -174.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.7 t -127.97 12.57 6.72 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.734 0.778 . . . . 25.0 111.031 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -78.96 -30.06 44.3 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.306 -0.871 . . . . 25.0 113.121 -176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.438 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.1 m95 -124.81 165.23 18.38 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 110.309 -0.256 . . . . 25.0 110.309 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -66.44 127.62 33.0 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.454 -2.054 . . . . 25.0 105.454 170.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -101.68 107.96 19.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 100.418 -3.919 . . . . 25.0 100.418 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.19 135.37 53.38 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.915 -1.039 . . . . 25.0 110.139 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -90.41 100.89 13.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.596 -1.261 . . . . 25.0 107.596 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.1 mt -130.24 173.94 10.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.756 -1.572 . . . . 25.0 106.756 -176.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -115.26 166.46 11.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.654 0.74 . . . . 25.0 112.811 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.425 HG21 ' HA ' ' A' ' 139' ' ' ALA . 75.3 p -77.04 171.02 15.47 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.461 -1.681 . . . . 25.0 106.461 173.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.36 -162.53 33.49 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 120.585 -0.817 . . . . 25.0 111.452 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.57 131.29 39.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 118.82 1.31 . . . . 25.0 114.628 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -136.07 159.34 42.01 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.693 -1.966 . . . . 25.0 105.693 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.1 p -99.18 151.01 21.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.307 -1.368 . . . . 25.0 107.307 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -138.72 101.05 4.23 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.8 122.69 46.26 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.481 -0.933 . . . . 25.0 108.481 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -108.22 147.51 31.26 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.8 -1.091 . . . . 25.0 109.399 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -126.73 115.12 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.089 -2.559 . . . . 25.0 104.089 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -113.91 132.91 55.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.384 -0.825 . . . . 25.0 111.411 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.8 t -93.06 6.15 48.97 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.428 0.632 . . . . 25.0 109.992 173.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -118.48 138.33 52.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.026 0.441 . . . . 25.0 110.431 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -91.19 -9.19 46.3 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.635 0.606 . . . . 25.0 112.635 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -68.1 157.38 35.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.259 0.466 . . . . 25.0 112.259 -176.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.1 t -75.59 155.97 35.41 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 114.631 1.345 . . . . 25.0 114.631 -172.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.3 t -97.63 158.91 15.24 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.198 -0.91 . . . . 25.0 108.664 173.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -118.02 -15.24 9.94 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.149 0.281 . . . . 25.0 111.63 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 t -171.89 154.13 3.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.009 0.433 . . . . 25.0 111.507 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -127.13 142.01 51.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.537 -2.394 . . . . 25.0 104.537 167.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -147.12 154.57 41.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.668 -0.864 . . . . 25.0 108.668 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -137.96 136.79 37.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 106.379 -1.712 . . . . 25.0 106.379 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.98 161.87 41.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.284 0.493 . . . . 25.0 110.065 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.88 165.79 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 113.927 1.084 . . . . 25.0 113.927 -167.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -79.94 161.13 25.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 169.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.72 158.88 38.4 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.197 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.07 -19.15 39.78 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 117.4 -1.267 . . . . 25.0 114.231 -174.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -120.81 31.92 6.2 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 122.764 0.426 . . . . 25.0 111.554 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.493 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.7 p-90 -73.68 164.39 26.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.934 0.874 . . . . 25.0 112.68 -177.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.18 101.0 10.92 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.657 -1.156 . . . . 25.0 109.847 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.493 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.2 15.96 5.69 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.656 2.095 . . . . 25.0 116.656 -169.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.5 t -125.57 9.01 7.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.754 0.788 . . . . 25.0 109.12 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.7 156.18 41.92 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 114.585 -1.189 . . . . 25.0 107.943 -174.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.74 155.43 70.54 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 O-C-N 121.953 0.449 . . . . 25.0 111.673 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.41 101.09 2.83 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.587 0.708 . . . . 25.0 112.269 -175.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.9 p -89.59 155.9 18.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.255 -1.017 . . . . 25.0 108.255 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -64.34 -26.64 68.56 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.916 -0.49 . . . . 25.0 111.232 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.05 -25.13 63.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.583 -0.735 . . . . 25.0 112.464 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.8 t -79.44 -10.31 59.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.078 0.399 . . . . 25.0 112.078 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -99.4 155.87 17.31 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 114.323 1.231 . . . . 25.0 114.323 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -94.0 94.98 8.75 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 102.251 -3.24 . . . . 25.0 102.251 161.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.5 mt -66.18 -6.39 13.36 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.812 1.412 . . . . 25.0 114.812 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.5 t -85.75 127.51 62.39 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 108.602 -0.888 . . . . 25.0 108.602 176.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.44 150.3 57.79 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 115.644 -2.437 . . . . 25.0 111.459 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -101.72 -7.79 22.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.095 0.474 . . . . 25.0 111.362 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 57.3 m -148.67 68.95 1.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 25.0 109.764 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -89.08 125.37 34.99 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.705 -0.85 . . . . 25.0 108.705 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -118.92 98.92 6.43 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.058 -2.201 . . . . 25.0 105.058 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -87.96 92.05 8.99 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.019 -0.734 . . . . 25.0 109.019 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -109.67 118.83 37.59 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 106.814 -1.55 . . . . 25.0 106.814 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.54 82.51 0.34 Allowed Glycine 0 CA--C 1.5 -0.869 0 CA-C-N 115.601 -0.727 . . . . 25.0 112.862 -169.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.03 16.37 6.26 Favored Glycine 0 C--N 1.321 -0.293 0 C-N-CA 120.982 -0.628 . . . . 25.0 113.151 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.05 103.94 4.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 121.564 0.697 . . . . 25.0 109.525 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.67 125.29 91.3 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 106.164 -1.791 . . . . 25.0 106.164 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.53 167.47 26.47 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 118.197 -0.736 . . . . 25.0 113.749 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.73 26.95 4.68 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.71 -10.15 0.62 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.82 1.648 . . . . 25.0 111.656 -173.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.4 mt-30 -131.02 152.38 50.38 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 103.838 -2.652 . . . . 25.0 103.838 170.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -141.49 94.95 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 106.421 -1.696 . . . . 25.0 106.421 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -88.14 140.94 28.98 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 104.749 -2.315 . . . . 25.0 104.749 173.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.7 166.92 27.92 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.101 -1.814 . . . . 25.0 106.101 -177.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -134.49 152.96 52.13 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.722 -2.325 . . . . 25.0 104.722 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 158.86 34.76 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.515 -1.291 . . . . 25.0 107.515 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -105.29 116.58 32.19 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.247 0.342 . . . . 25.0 111.408 -174.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 57.7 mt -77.68 131.94 69.69 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -61.64 147.1 96.16 Favored 'Trans proline' 0 C--N 1.353 0.763 0 N-CA-C 113.762 0.639 . . . . 25.0 113.762 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.425 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.74 -27.26 40.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.079 -0.964 . . . . 25.0 112.696 -169.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -83.99 9.77 11.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.62 -0.718 . . . . 25.0 110.185 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -116.2 50.42 1.04 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 172.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 42.3 p -86.07 160.49 19.28 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 175.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 94.4 -168.49 28.24 Favored Glycine 0 C--O 1.237 0.326 0 N-CA-C 114.285 0.474 . . . . 25.0 114.285 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.5 t -86.14 114.89 23.35 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.352 0.596 . . . . 25.0 111.181 -169.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.9 p-80 -160.0 171.7 18.87 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.75 -0.659 . . . . 25.0 110.257 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -107.15 151.6 8.99 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 107.757 -1.201 . . . . 25.0 107.757 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.1 mt -132.93 121.9 45.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.57 129.87 52.6 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.635 -0.712 . . . . 25.0 109.748 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -114.6 130.82 56.82 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 108.973 -0.751 . . . . 25.0 108.973 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 1.7 p -125.46 137.55 57.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 122.043 0.925 . . . . 25.0 112.637 -177.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -111.92 118.46 35.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.77 -1.559 . . . . 25.0 106.954 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -98.63 125.31 43.87 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.539 -0.911 . . . . 25.0 108.539 178.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 21.7 mm -80.55 141.59 15.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.309 -0.626 . . . . 25.0 109.309 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.35 21.65 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.723 0.692 . . . . 25.0 110.476 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.01 -23.72 65.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.993 1.108 . . . . 25.0 113.993 -171.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.2 p -138.95 168.62 19.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.958 0.885 . . . . 25.0 110.248 -174.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.76 28.74 0.33 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.348 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -99.11 145.78 26.8 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.964 0.727 . . . . 25.0 112.964 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.3 146.13 15.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.279 -2.119 . . . . 25.0 105.279 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -148.16 138.11 22.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 111.87 0.322 . . . . 25.0 111.87 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.03 113.22 25.02 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 123.735 0.647 . . . . 25.0 111.205 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -97.06 111.9 23.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.981 -0.748 . . . . 25.0 108.981 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.42 141.13 30.19 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.467 0.543 . . . . 25.0 112.467 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' ILE . . . . . 0.418 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.3 tt -125.94 135.45 63.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 105.637 -1.986 . . . . 25.0 105.637 166.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -94.43 131.63 39.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.17 -1.419 . . . . 25.0 107.17 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.8 m -132.17 162.01 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.807 0.669 . . . . 25.0 112.807 -175.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -119.74 95.0 4.59 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.392 -2.447 . . . . 25.0 104.392 169.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.17 162.75 14.53 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 112.903 0.705 . . . . 25.0 112.903 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.4 p -145.92 161.1 40.81 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.425 -0.954 . . . . 25.0 108.425 174.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.888 -0.577 . . . . 25.0 110.558 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.476 0.655 . . . . 25.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.17 168.99 37.14 Favored Glycine 0 CA--C 1.509 -0.293 1 N-CA-C 101.691 -4.564 . . . . 25.0 101.691 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 p90 -146.83 165.06 30.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.318 2.059 . . . . 25.0 110.583 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.65 123.33 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.199 -1.037 . . . . 25.0 108.199 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.09 -43.08 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.63 -1.168 . . . . 25.0 109.883 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 t -154.24 129.2 4.94 Favored Pre-proline 0 C--N 1.321 -0.666 0 N-CA-C 106.35 -1.722 . . . . 25.0 106.35 177.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.404 ' HB2' HD13 ' A' ' 164' ' ' ILE . 67.3 Cg_endo -65.17 131.25 12.46 Favored 'Cis proline' 0 CA--C 1.532 0.418 0 C-N-CA 128.903 0.793 . . . . 25.0 110.92 -0.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.93 112.4 4.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.023 -0.535 . . . . 25.0 112.129 -172.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.9 t -72.23 157.84 36.98 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 107.566 -1.272 . . . . 25.0 107.566 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -55.48 -25.06 34.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.138 0.575 . . . . 25.0 112.238 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.61 -53.48 46.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.807 0.813 . . . . 25.0 109.447 175.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -70.39 -32.46 70.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.63 -0.714 . . . . 25.0 110.925 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -63.51 -32.4 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.847 -0.533 . . . . 25.0 110.374 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -40.3 96.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.38 0.609 . . . . 25.0 109.47 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -66.18 -36.15 82.32 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.887 -0.597 . . . . 25.0 110.206 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -78.24 5.3 10.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 25.0 111.518 177.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 58.35 24.45 11.66 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.158 1.383 . . . . 25.0 112.69 -179.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -89.74 -21.65 22.57 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.933 -1.136 . . . . 25.0 107.933 174.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -122.93 159.12 28.94 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 106.581 -1.637 . . . . 25.0 106.581 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.2 p -133.04 176.51 8.43 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -175.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 71.94 0.09 3.41 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.624 1.713 . . . . 25.0 115.624 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.1 m -65.95 -43.33 88.29 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 121.633 -0.667 . . . . 25.0 111.745 175.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.73 -63.24 1.94 Allowed Glycine 0 C--O 1.218 -0.891 0 O-C-N 123.598 0.561 . . . . 25.0 111.939 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -87.67 -51.46 5.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.989 0.899 . . . . 25.0 111.857 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.3 t -66.66 -13.2 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.177 -0.92 . . . . 25.0 113.235 -172.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.87 -4.99 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.436 -0.79 . . . . 25.0 111.857 178.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -112.56 -34.07 5.95 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 25.0 109.515 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.3 100.45 29.46 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.399 -0.593 . . . . 25.0 109.399 172.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.1 -19.87 22.34 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.758 -1.028 . . . . 25.0 113.793 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -88.82 15.78 7.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.187 0.439 . . . . 25.0 112.187 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 71.2 m -63.22 -23.13 67.29 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.978 0.418 . . . . 25.0 111.585 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 4.4 m -64.04 122.0 14.1 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 115.371 1.619 . . . . 25.0 115.371 -175.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -152.88 159.04 42.98 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 174.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.03 -165.48 17.02 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 108.333 -1.907 . . . . 25.0 108.333 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.04 148.09 45.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.437 1.118 . . . . 25.0 112.546 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -67.27 156.87 35.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.336 -1.357 . . . . 25.0 107.336 171.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.32 -3.49 1.91 Allowed Glycine 0 C--O 1.224 -0.522 0 CA-C-N 114.816 -1.084 . . . . 25.0 112.309 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -75.93 144.06 75.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 O-C-N 121.826 -0.809 . . . . 25.0 108.861 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -91.48 -17.32 15.96 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 N-CA-C 115.581 1.339 . . . . 25.0 115.581 -5.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -70.67 -35.34 72.79 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.73 1.381 . . . . 25.0 114.73 -169.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -119.01 35.14 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.547 -2.02 . . . . 25.0 105.547 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.12 177.21 47.57 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.617 -1.174 . . . . 25.0 111.691 -177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.94 172.2 4.15 Favored 'Trans proline' 0 C--O 1.241 0.635 0 C-N-CA 123.924 3.082 . . . . 25.0 113.821 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.96 159.86 31.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.789 -1.56 . . . . 25.0 106.789 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.17 138.68 57.86 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.258 -1.337 . . . . 25.0 107.438 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.08 -4.7 82.48 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.258 -0.496 . . . . 25.0 113.063 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.406 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.2 m170 -124.27 9.27 8.55 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.253 -0.647 . . . . 25.0 109.253 178.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.3 mt -64.87 -49.49 79.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.703 -0.226 . . . . 25.0 111.259 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.58 -29.3 63.4 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 p -77.54 -8.29 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.596 0.962 . . . . 25.0 113.596 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.52 34.26 18.02 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.641 0.776 . . . . 25.0 109.816 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.29 38.51 26.02 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.956 1.465 . . . . 25.0 114.956 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -119.67 134.73 55.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.106 0.562 . . . . 25.0 111.108 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 p -62.29 -34.7 77.09 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.915 1.82 . . . . 25.0 115.915 -173.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' H ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -70.42 -7.66 44.86 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.251 0.548 . . . . 25.0 112.437 -177.773 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.695 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.8 m-85 -122.51 14.23 10.25 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 107.521 -1.289 . . . . 25.0 107.521 -178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.49 -38.17 71.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.227 -0.921 . . . . 25.0 110.405 -176.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -71.5 -17.34 62.35 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 122.032 0.92 . . . . 25.0 109.345 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.2 mp -83.61 -5.94 59.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.553 -0.906 . . . . 25.0 108.553 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -111.82 -32.06 6.74 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -96.58 116.45 29.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 121.471 -0.768 . . . . 25.0 111.127 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.459 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -122.64 160.55 25.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.881 -0.6 . . . . 25.0 109.466 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 6.1 p -116.93 162.57 26.78 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 100.541 -3.874 . . . . 25.0 100.541 162.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.55 -5.38 15.1 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 116.852 -1.632 . . . . 25.0 115.763 -175.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 t -125.67 12.38 7.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.291 0.567 . . . . 25.0 111.419 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -77.67 -29.44 51.55 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.817 0.673 . . . . 25.0 112.817 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.459 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.0 m95 -126.8 168.07 14.93 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 120.674 0.273 . . . . 25.0 110.505 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.0 t-20 -66.77 131.02 45.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 105.436 -2.061 . . . . 25.0 105.436 168.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -104.94 108.09 19.41 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 100.587 -3.857 . . . . 25.0 100.587 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.0 135.83 54.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 114.891 -1.05 . . . . 25.0 110.178 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -92.56 100.22 12.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.626 -1.17 . . . . 25.0 107.91 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.78 173.88 10.71 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.132 -1.803 . . . . 25.0 106.132 -176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -116.09 166.18 12.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.629 0.974 . . . . 25.0 113.629 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.408 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.3 p -77.04 169.14 18.87 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 174.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.96 -162.25 28.6 Favored Glycine 0 C--O 1.241 0.544 0 N-CA-C 111.078 -0.809 . . . . 25.0 111.078 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.08 133.32 52.46 Favored 'Trans proline' 0 C--N 1.346 0.422 0 CA-C-N 118.889 1.345 . . . . 25.0 114.212 -177.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -138.38 161.62 36.5 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.438 -1.69 . . . . 25.0 106.438 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -104.63 152.29 22.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.216 -1.401 . . . . 25.0 107.216 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -140.77 100.95 3.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.06 -1.83 . . . . 25.0 106.06 -176.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.46 113.8 27.58 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.83 0.824 . . . . 25.0 109.657 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.9 m95 -105.34 152.96 22.28 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.432 -0.804 . . . . 25.0 110.765 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -128.14 114.16 16.65 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.2 mp -115.85 104.92 12.11 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.297 -0.865 . . . . 25.0 112.812 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.9 t -70.91 -22.82 62.2 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.832 -0.803 . . . . 25.0 108.832 171.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.1 98.96 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 175.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -70.04 -18.9 63.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.297 1.221 . . . . 25.0 114.297 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -78.84 167.11 21.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.671 0.619 . . . . 25.0 112.671 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.6 t -64.54 155.54 32.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 117.254 2.316 . . . . 25.0 117.254 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 t -103.52 158.83 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 172.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.97 -12.76 10.07 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.398 0.518 . . . . 25.0 112.398 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.2 t -171.4 151.93 3.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.019 0.438 . . . . 25.0 112.171 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.5 m95 -127.23 139.76 52.69 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.105 -2.554 . . . . 25.0 104.105 167.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -145.82 144.59 30.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.37 -1.344 . . . . 25.0 107.37 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -133.86 134.47 42.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -149.29 163.13 38.56 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.556 -0.535 . . . . 25.0 109.556 178.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.85 165.12 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 113.685 0.994 . . . . 25.0 113.685 -168.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 16.6 p -79.11 161.69 26.33 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 169.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -61.14 159.04 31.54 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 25.0 109.205 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.72 -25.24 34.01 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 116.096 -2.136 . . . . 25.0 113.314 -175.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -114.43 32.06 6.2 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.034 0.534 . . . . 25.0 110.632 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.9 p-90 -73.24 167.41 21.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 122.029 0.918 . . . . 25.0 113.032 -176.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -83.16 101.08 10.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.447 -1.251 . . . . 25.0 109.59 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -93.48 8.56 40.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 14.1 t -118.03 9.76 12.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.401 -0.963 . . . . 25.0 108.401 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -115.11 157.76 42.72 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.115 -1.402 . . . . 25.0 107.599 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -65.67 157.46 58.55 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 O-C-N 121.982 0.464 . . . . 25.0 111.226 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.93 100.95 2.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.227 0.537 . . . . 25.0 111.722 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.1 p -89.31 156.99 18.37 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.305 -1.368 . . . . 25.0 107.305 174.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.66 -24.93 66.35 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.44 0.638 . . . . 25.0 110.762 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.7 -25.96 64.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.996 -1.002 . . . . 25.0 112.914 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 m -80.6 -8.34 59.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 25.0 112.396 -177.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 41.9 m-85 -98.13 154.28 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 115.158 1.54 . . . . 25.0 115.158 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -97.02 96.44 8.48 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 102.614 -3.106 . . . . 25.0 102.614 162.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.92 -7.28 20.94 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -169.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -80.65 132.28 58.56 Favored Pre-proline 0 C--N 1.323 -0.58 0 N-CA-C 109.122 -0.696 . . . . 25.0 109.122 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -73.74 152.3 47.33 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 115.069 -2.821 . . . . 25.0 111.082 177.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -107.46 -11.41 15.51 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.988 0.423 . . . . 25.0 111.49 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.3 m -149.32 67.91 1.03 Allowed 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.317 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.58 138.99 30.99 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.126 -1.03 . . . . 25.0 108.738 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.79 101.04 5.71 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 104.715 -2.328 . . . . 25.0 104.715 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -94.56 92.19 6.95 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.5 -0.926 . . . . 25.0 108.5 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -108.55 122.08 46.31 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 107.067 -1.457 . . . . 25.0 107.067 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.39 37.74 3.4 Favored Glycine 0 C--O 1.224 -0.489 0 N-CA-C 117.129 1.612 . . . . 25.0 117.129 -168.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 162.38 23.92 0.02 OUTLIER Glycine 0 C--N 1.319 -0.389 0 C-N-CA 120.354 -0.927 . . . . 25.0 113.452 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.62 104.16 9.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.381 0.61 . . . . 25.0 110.323 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 91.4 mt -75.47 123.57 88.62 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 104.894 -2.262 . . . . 25.0 104.894 173.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.75 165.34 33.01 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 117.725 -1.05 . . . . 25.0 113.577 -175.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.415 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.8 26.33 3.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 175.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.64 -8.43 0.92 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.987 1.715 . . . . 25.0 111.228 -173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.9 mt-30 -135.04 153.65 51.98 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.064 -2.569 . . . . 25.0 104.064 171.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.72 95.28 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.71 141.94 29.37 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 104.058 -2.571 . . . . 25.0 104.058 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.32 167.03 31.33 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.549 -1.659 . . . . 25.0 109.323 -176.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -134.54 157.38 46.69 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.655 -1.609 . . . . 25.0 106.655 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.46 160.89 26.8 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -108.22 114.98 29.28 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.333 0.396 . . . . 25.0 111.316 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.3 mt -78.58 132.76 64.36 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.68 -0.859 . . . . 25.0 108.68 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -62.35 147.44 94.94 Favored 'Trans proline' 0 C--N 1.354 0.841 0 CA-C-N 118.741 0.586 . . . . 25.0 113.611 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.408 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.55 -26.25 35.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 25.0 112.895 -169.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 p-10 -84.0 9.02 13.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 25.0 110.055 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -116.54 53.43 0.88 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 172.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.5 p -86.91 168.35 13.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 106.525 -1.657 . . . . 25.0 106.525 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 89.67 -167.55 33.76 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 115.535 0.974 . . . . 25.0 115.535 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.2 t -85.84 107.99 17.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.315 0.579 . . . . 25.0 110.707 -169.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -157.12 171.45 20.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.875 -0.602 . . . . 25.0 110.866 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.24 151.25 9.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 N-CA-C 107.816 -1.179 . . . . 25.0 107.816 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.8 mt -131.88 120.64 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 104.758 -2.312 . . . . 25.0 104.758 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.95 130.38 50.0 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.744 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.27 122.27 42.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.487 -0.931 . . . . 25.0 108.487 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.33 140.24 36.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 122.077 0.942 . . . . 25.0 110.197 -178.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -124.25 122.21 37.15 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.25 129.43 50.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 123.238 0.615 . . . . 25.0 109.963 -175.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 43.7 mm -78.06 140.93 16.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.681 -0.489 . . . . 25.0 109.681 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.41 -44.27 25.29 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.773 0.715 . . . . 25.0 111.027 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.26 -23.03 64.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 114.659 1.355 . . . . 25.0 114.659 -172.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.6 p -139.29 170.88 15.13 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.921 0.867 . . . . 25.0 109.707 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.82 23.06 0.56 Allowed 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.365 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -94.2 143.75 26.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.593 -0.692 . . . . 25.0 112.822 -176.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.28 145.58 16.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 104.647 -2.353 . . . . 25.0 104.647 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -147.52 140.01 24.63 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.083 0.771 . . . . 25.0 113.083 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -94.63 112.3 24.05 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.63 0.772 . . . . 25.0 111.496 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -97.06 108.21 20.9 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.38 141.08 29.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.311 -0.859 . . . . 25.0 111.83 -176.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' ILE . . . . . 0.404 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.4 tt -125.58 134.59 66.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.187 -1.783 . . . . 25.0 106.187 167.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.34 130.67 39.02 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.317 -1.364 . . . . 25.0 107.317 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.3 m -131.54 161.19 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 112.81 0.67 . . . . 25.0 112.81 -175.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -118.67 95.1 4.71 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 104.059 -2.571 . . . . 25.0 104.059 168.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -93.14 160.42 14.85 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 113.172 0.804 . . . . 25.0 113.172 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 65.6 p -145.97 167.17 23.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.77 -0.826 . . . . 25.0 108.77 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.869 -0.586 . . . . 25.0 109.94 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.8 m80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.248 -0.278 . . . . 25.0 110.248 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.01 170.59 12.9 Favored Glycine 0 C--N 1.322 -0.201 0 N-CA-C 103.507 -3.837 . . . . 25.0 103.507 -172.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -148.85 169.92 19.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 119.594 1.697 . . . . 25.0 111.385 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 126.11 62.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.031 -1.47 . . . . 25.0 107.031 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.64 -43.01 49.91 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.388 -0.824 . . . . 25.0 109.408 -175.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -153.56 133.57 7.62 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 105.503 -2.036 . . . . 25.0 105.503 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -65.25 135.46 23.53 Favored 'Cis proline' 0 CA--C 1.533 0.469 0 C-N-CA 128.754 0.731 . . . . 25.0 111.999 0.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.17 107.36 1.92 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.773 -0.649 . . . . 25.0 112.431 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 t -71.85 156.69 39.01 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.634 -0.506 . . . . 25.0 109.634 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 -55.4 -25.93 38.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.815 0.846 . . . . 25.0 112.444 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.25 -53.36 45.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.798 0.809 . . . . 25.0 109.134 175.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -66.37 -33.92 76.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.506 -0.77 . . . . 25.0 110.84 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.17 -33.2 75.24 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.948 -0.47 . . . . 25.0 110.244 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -37.52 84.83 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 178.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -62.66 -39.22 93.24 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.257 0.551 . . . . 25.0 109.857 175.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.2 mt -77.45 5.12 9.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.025 -0.534 . . . . 25.0 112.117 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 58.62 22.13 9.48 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.115 1.366 . . . . 25.0 112.814 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.1 mt -85.2 -20.16 30.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.895 -1.15 . . . . 25.0 107.895 174.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -121.81 156.72 32.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.314 -1.735 . . . . 25.0 106.314 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 p -134.58 175.98 9.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.366 -0.605 . . . . 25.0 109.366 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 68.08 5.01 4.36 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 175.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.2 m -67.25 -33.15 74.73 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 121.451 -0.781 . . . . 25.0 111.777 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.66 -62.61 1.55 Allowed Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.733 0.645 . . . . 25.0 112.376 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 t -91.75 -50.81 5.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 114.945 1.461 . . . . 25.0 114.945 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.98 -14.28 13.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.122 -1.399 . . . . 25.0 114.12 -165.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -79.45 -7.6 58.53 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.574 -0.85 . . . . 25.0 112.382 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -104.14 -38.92 6.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.229 -0.988 . . . . 25.0 111.048 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -131.21 95.98 23.2 Favored Pre-proline 0 C--O 1.241 0.641 0 N-CA-C 111.785 0.291 . . . . 25.0 111.785 168.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.26 -19.06 29.73 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 116.91 -1.593 . . . . 25.0 115.383 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -81.42 5.57 17.2 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 121.575 -0.703 . . . . 25.0 112.178 -178.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.4 m -66.45 -12.35 56.78 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.77 0.656 . . . . 25.0 112.77 177.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.05 132.88 29.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.881 0.848 . . . . 25.0 112.782 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -152.98 150.42 29.21 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.64 -168.38 17.92 Favored Glycine 0 CA--C 1.51 -0.261 0 N-CA-C 109.504 -1.439 . . . . 25.0 109.504 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -127.92 146.64 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.764 0.782 . . . . 25.0 111.174 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.98 157.01 29.42 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.176 -1.046 . . . . 25.0 108.176 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.27 -4.0 1.99 Allowed Glycine 0 C--N 1.318 -0.451 0 CA-C-N 114.726 -1.124 . . . . 25.0 112.847 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -75.96 148.09 81.29 Favored Pre-proline 0 C--N 1.321 -0.632 0 O-C-N 121.623 -0.928 . . . . 25.0 109.075 -177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -90.8 -18.64 14.53 Favored 'Cis proline' 0 CA--C 1.541 0.875 0 N-CA-C 115.95 1.481 . . . . 25.0 115.95 -4.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -77.77 -35.8 51.28 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.924 1.453 . . . . 25.0 114.924 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.02 33.27 5.33 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.364 -1.717 . . . . 25.0 106.364 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.07 -174.86 45.26 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.626 -1.17 . . . . 25.0 111.415 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -60.44 171.5 3.3 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 123.793 2.995 . . . . 25.0 113.322 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.14 159.98 30.99 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.23 137.38 58.0 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 106.652 -1.61 . . . . 25.0 106.652 176.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.21 -6.04 82.7 Favored Glycine 0 CA--C 1.509 -0.298 0 CA-C-O 121.416 0.453 . . . . 25.0 113.413 -174.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 51.0 m170 -125.02 10.04 8.15 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.404 -0.468 . . . . 25.0 110.218 179.209 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.8 mt -64.23 -48.77 84.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.443 -0.16 . . . . 25.0 111.232 -173.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.81 -24.34 55.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.072 0.463 . . . . 25.0 110.004 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.3 p -81.62 -8.61 59.73 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.031 0.752 . . . . 25.0 113.031 -176.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.89 34.79 17.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.714 0.805 . . . . 25.0 110.075 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.416 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.44 41.11 23.33 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -177.818 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -121.34 135.01 55.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.287 0.635 . . . . 25.0 110.781 174.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.56 -34.44 77.81 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 115.497 1.665 . . . . 25.0 115.497 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 t -71.42 -8.05 51.32 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.347 0.594 . . . . 25.0 112.346 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.705 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.3 m-85 -119.1 15.02 13.22 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.447 -1.316 . . . . 25.0 107.447 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.81 -37.89 70.31 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.1 -1.0 . . . . 25.0 110.401 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.4 mp0 -70.2 -16.31 63.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.879 0.847 . . . . 25.0 110.042 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.4 mp -86.16 -5.72 59.14 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -112.49 -32.31 6.52 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.104 0.409 . . . . 25.0 112.104 173.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -96.07 121.89 38.32 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 121.628 -0.67 . . . . 25.0 110.185 -178.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.453 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -128.03 160.87 30.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.504 -0.771 . . . . 25.0 109.731 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.3 p -114.39 161.19 29.75 Favored Pre-proline 0 C--N 1.319 -0.74 1 N-CA-C 100.11 -4.033 . . . . 25.0 100.11 161.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 -2.16 9.67 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 116.961 -1.56 . . . . 25.0 115.765 -174.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -127.34 11.73 6.94 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.231 0.539 . . . . 25.0 111.65 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -78.93 -31.05 45.05 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.028 0.751 . . . . 25.0 113.028 -176.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.9 m95 -122.58 167.17 13.73 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 110.047 -0.353 . . . . 25.0 110.047 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -68.19 125.0 24.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.009 -1.848 . . . . 25.0 106.009 172.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -100.44 106.11 17.65 Favored 'General case' 0 CA--C 1.5 -0.981 0 N-CA-C 100.511 -3.885 . . . . 25.0 100.511 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.32 135.75 52.36 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.97 -1.014 . . . . 25.0 110.81 -176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -88.89 100.84 13.49 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 107.912 -1.144 . . . . 25.0 107.912 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.77 174.05 10.33 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.883 -1.895 . . . . 25.0 105.883 -177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -115.42 166.51 11.8 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.687 0.995 . . . . 25.0 113.687 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 72.5 p -77.12 171.61 14.55 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 106.297 -1.742 . . . . 25.0 106.297 173.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.99 -161.35 33.05 Favored Glycine 0 C--O 1.24 0.517 0 C-N-CA 120.436 -0.888 . . . . 25.0 111.198 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.09 132.95 50.06 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 119.013 1.406 . . . . 25.0 114.392 -176.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -139.41 158.74 43.62 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.7 p -100.2 150.18 22.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -139.11 100.93 4.15 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 105.527 -2.027 . . . . 25.0 105.527 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.54 111.07 23.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.008 0.909 . . . . 25.0 111.004 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -97.8 147.42 24.41 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.305 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -124.01 110.55 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.602 -2.37 . . . . 25.0 104.602 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.44 130.91 45.74 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.166 -0.925 . . . . 25.0 109.478 -171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.7 t -72.73 -10.92 60.36 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.672 0.619 . . . . 25.0 112.672 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.98 147.6 27.35 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.805 -0.813 . . . . 25.0 108.805 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 mtm180 -81.22 13.68 2.74 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.287 0.847 . . . . 25.0 113.287 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.98 152.36 32.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.956 -0.757 . . . . 25.0 108.956 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.1 t -69.47 155.95 39.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.723 1.009 . . . . 25.0 113.723 -170.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.477 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 3.1 t -102.19 156.55 17.49 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.276 -1.379 . . . . 25.0 107.276 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.84 -15.94 10.0 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.168 0.293 . . . . 25.0 110.771 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 t -172.54 152.08 2.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.891 0.377 . . . . 25.0 111.975 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.67 140.71 52.72 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 103.687 -2.709 . . . . 25.0 103.687 166.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -145.82 150.97 37.15 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.089 0.859 . . . . 25.0 108.978 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -137.98 137.49 37.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.084 -1.821 . . . . 25.0 106.084 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -147.88 160.09 43.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.24 164.5 34.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.217 0.821 . . . . 25.0 113.217 -168.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 p -79.76 162.51 25.1 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.434 -0.95 . . . . 25.0 108.434 171.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -64.06 161.87 35.81 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.249 -0.887 . . . . 25.0 109.472 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.59 -18.73 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 116.505 -1.863 . . . . 25.0 113.812 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.83 32.01 6.16 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.129 0.571 . . . . 25.0 111.034 -177.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.475 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 10.4 p-90 -68.94 172.68 6.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.293 1.22 . . . . 25.0 114.293 -176.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -83.11 98.41 9.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.0 -1.0 . . . . 25.0 109.099 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.475 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -96.27 5.3 51.28 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.913 1.82 . . . . 25.0 115.913 -168.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -128.42 17.22 6.5 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -122.53 161.0 45.99 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 114.195 -1.366 . . . . 25.0 107.503 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.96 151.92 82.05 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 118.443 -0.571 . . . . 25.0 111.133 173.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 108.81 3.44 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.554 0.575 . . . . 25.0 112.554 -175.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.7 p -95.66 153.31 17.79 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.126 -1.065 . . . . 25.0 108.126 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -68.13 -22.59 64.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.422 0.63 . . . . 25.0 110.111 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.81 -29.65 68.87 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.943 -1.026 . . . . 25.0 112.28 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.76 -3.04 59.0 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.045 0.387 . . . . 25.0 112.045 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -100.01 152.27 20.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 114.021 1.119 . . . . 25.0 114.021 -177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -97.02 92.85 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.632 -2.729 . . . . 25.0 103.632 165.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.0 mt -66.66 -6.49 15.72 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.564 1.32 . . . . 25.0 114.564 -170.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.43 122.02 78.69 Favored Pre-proline 0 C--N 1.323 -0.543 0 N-CA-C 108.856 -0.794 . . . . 25.0 108.856 176.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.85 135.6 28.22 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 115.26 -2.693 . . . . 25.0 111.945 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -87.0 -13.62 43.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 -175.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.2 m -146.55 63.32 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.508 -0.314 . . . . 25.0 111.828 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -89.07 134.92 33.82 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 118.152 -1.419 . . . . 25.0 108.874 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -122.58 98.99 6.17 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 104.239 -2.504 . . . . 25.0 104.239 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -90.32 92.05 8.75 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.045 -1.095 . . . . 25.0 108.045 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -106.31 122.06 45.49 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.75 84.11 0.39 Allowed Glycine 0 CA--C 1.504 -0.602 0 CA-C-N 115.123 -0.944 . . . . 25.0 112.811 -171.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.56 15.63 13.31 Favored Glycine 0 C--N 1.32 -0.337 0 C-N-CA 120.901 -0.666 . . . . 25.0 113.464 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.13 106.73 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.366 -0.976 . . . . 25.0 108.366 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 79.2 mt -72.48 117.58 60.2 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 107.583 -1.266 . . . . 25.0 107.583 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -76.94 166.89 26.11 Favored 'Trans proline' 0 C--N 1.345 0.35 0 N-CA-C 114.682 0.993 . . . . 25.0 114.682 -176.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.44 26.39 4.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.763 -0.829 . . . . 25.0 108.763 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.72 -16.89 0.37 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.688 1.595 . . . . 25.0 112.33 -175.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -129.31 146.96 51.11 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 103.988 -2.597 . . . . 25.0 103.988 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.8 t -138.71 95.03 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -89.26 132.66 34.79 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 104.662 -2.348 . . . . 25.0 104.662 173.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -145.2 166.98 23.88 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -175.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -132.11 156.39 46.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.85 159.87 33.03 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -104.67 119.03 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.08 0.238 . . . . 25.0 111.191 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.27 132.81 61.7 Favored Pre-proline 0 C--O 1.24 0.6 0 N-CA-C 108.276 -1.009 . . . . 25.0 108.276 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -60.64 147.41 94.83 Favored 'Trans proline' 0 C--N 1.354 0.844 0 N-CA-C 113.84 0.669 . . . . 25.0 113.84 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.41 -26.46 35.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.159 -0.928 . . . . 25.0 112.717 -169.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -83.63 10.35 9.4 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.744 0.783 . . . . 25.0 110.208 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -115.97 51.4 0.96 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.43 -0.952 . . . . 25.0 108.43 172.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.4 p -86.24 162.22 18.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.582 -1.636 . . . . 25.0 106.582 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.6 -165.68 29.9 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 114.839 0.696 . . . . 25.0 114.839 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 37.4 t -85.85 110.85 19.68 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.491 0.662 . . . . 25.0 110.954 -168.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -157.39 170.98 21.22 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 115.72 -0.673 . . . . 25.0 110.493 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.63 151.54 11.88 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 107.725 -1.213 . . . . 25.0 107.725 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 58.8 mt -131.55 121.27 47.7 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 104.809 -2.293 . . . . 25.0 104.809 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -103.05 128.76 49.8 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.663 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.43 131.59 56.27 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 123.005 0.522 . . . . 25.0 109.804 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.42 145.76 34.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 122.125 0.965 . . . . 25.0 112.249 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.477 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 12.7 t90 -116.77 119.37 35.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 173.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.81 121.41 38.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 7.4 mm -77.28 143.51 12.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.156 -1.053 . . . . 25.0 108.156 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.54 -41.02 28.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.847 0.749 . . . . 25.0 109.637 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.16 -22.69 64.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.011 1.115 . . . . 25.0 114.011 -172.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -138.5 169.14 18.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.993 0.902 . . . . 25.0 110.236 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 17.96 1.45 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.162 -0.926 . . . . 25.0 111.969 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -90.03 144.65 25.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.915 0.709 . . . . 25.0 112.915 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.49 141.34 14.62 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.089 -2.189 . . . . 25.0 105.089 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -146.51 131.85 18.55 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 117.766 0.257 . . . . 25.0 111.432 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -89.95 117.32 28.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.955 -0.566 . . . . 25.0 110.916 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -96.96 107.99 20.62 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.1 140.79 32.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.641 -0.709 . . . . 25.0 111.999 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 134.4 66.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.404 -1.702 . . . . 25.0 106.404 168.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -92.47 132.21 36.98 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.886 -1.153 . . . . 25.0 107.886 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -133.54 161.74 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -176.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -120.64 95.0 4.54 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.637 -2.357 . . . . 25.0 104.637 169.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.58 160.1 16.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 113.277 0.843 . . . . 25.0 113.277 -170.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.4 p -145.8 166.58 25.51 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.821 -0.437 . . . . 25.0 109.821 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.709 -0.662 . . . . 25.0 110.333 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 47.0 m170 . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.963 0.411 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.66 30.97 Favored Glycine 0 N--CA 1.45 -0.377 1 N-CA-C 102.709 -4.156 . . . . 25.0 102.709 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -147.32 168.52 21.57 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 119.523 1.662 . . . . 25.0 109.276 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -105.28 122.83 59.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 108.147 -1.057 . . . . 25.0 108.147 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -72.22 -42.69 65.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.845 -1.071 . . . . 25.0 109.697 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 t -153.02 129.24 5.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -64.67 134.46 19.29 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 128.798 0.749 . . . . 25.0 111.585 -0.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 113.17 4.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.626 0.602 . . . . 25.0 112.626 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -72.11 155.03 40.73 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.104 -0.702 . . . . 25.0 109.104 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -56.74 -26.38 57.03 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.286 0.635 . . . . 25.0 112.163 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -48.41 63.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -66.38 -36.65 83.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.624 -0.716 . . . . 25.0 109.638 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.84 -33.43 75.66 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 122.228 -0.295 . . . . 25.0 110.587 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -39.64 93.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 25.0 109.96 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -66.63 -35.37 80.01 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.211 0.529 . . . . 25.0 110.071 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.4 mt -79.4 6.42 10.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.485 . . . . 25.0 111.731 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 59.09 21.45 9.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.056 1.343 . . . . 25.0 113.314 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.75 -20.62 25.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.996 -1.113 . . . . 25.0 107.996 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -123.33 158.95 29.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.075 -2.194 . . . . 25.0 105.075 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.1 p -135.38 174.68 10.34 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 122.307 0.243 . . . . 25.0 110.447 -175.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 69.71 5.08 5.03 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.978 1.844 . . . . 25.0 115.978 174.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.1 m -66.8 -39.25 87.69 Favored 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 121.483 -0.761 . . . . 25.0 110.491 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.87 -64.19 1.55 Allowed Glycine 0 C--O 1.217 -0.965 0 O-C-N 123.593 0.558 . . . . 25.0 112.303 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 t -88.01 -53.69 4.6 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.655 1.217 . . . . 25.0 111.592 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.2 OUTLIER -69.95 -6.9 7.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.32 -1.309 . . . . 25.0 113.377 -171.758 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.34 2.59 52.21 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.08 -0.387 . . . . 25.0 111.508 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -116.78 -37.93 3.54 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.4 -0.92 . . . . 25.0 111.383 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -127.51 93.68 39.99 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 122.047 0.139 . . . . 25.0 111.35 167.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' VAL . 83.5 Cg_endo -70.19 -19.33 34.23 Favored 'Trans proline' 0 C--N 1.343 0.28 0 N-CA-C 115.614 1.351 . . . . 25.0 115.614 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -82.44 4.95 22.16 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.703 -0.623 . . . . 25.0 112.398 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.1 m -68.55 -9.61 50.48 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 m -64.04 136.65 26.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 122.176 0.988 . . . . 25.0 112.916 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -153.02 160.26 42.97 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 103.742 -2.688 . . . . 25.0 103.742 177.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.84 -170.97 27.31 Favored Glycine 0 C--O 1.226 -0.389 0 N-CA-C 108.439 -1.865 . . . . 25.0 108.439 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.74 145.35 49.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 118.811 1.306 . . . . 25.0 112.142 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -66.57 156.98 33.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.24 1.66 2.81 Favored Glycine 0 C--O 1.224 -0.528 0 CA-C-N 114.921 -1.036 . . . . 25.0 113.114 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -76.06 140.86 70.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 121.633 -0.922 . . . . 25.0 108.848 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -92.66 -15.41 17.52 Favored 'Cis proline' 0 CA--C 1.544 0.993 0 N-CA-C 115.603 1.347 . . . . 25.0 115.603 -5.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.87 -36.3 72.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.878 1.436 . . . . 25.0 114.878 -169.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.15 30.21 7.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 105.612 -1.996 . . . . 25.0 105.612 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.57 -177.2 40.0 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 114.376 -1.284 . . . . 25.0 110.835 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -62.3 170.75 6.12 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.706 2.27 . . . . 25.0 113.445 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 159.95 31.1 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.381 -1.34 . . . . 25.0 107.381 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -61.41 139.08 58.26 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.767 -1.568 . . . . 25.0 106.767 174.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.52 -6.1 83.09 Favored Glycine 0 C--O 1.228 -0.228 0 CA-C-N 116.047 -0.524 . . . . 25.0 112.439 -173.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -126.2 11.19 7.54 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.53 -0.394 . . . . 25.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.28 -52.18 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 122.209 -0.307 . . . . 25.0 111.556 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.59 -21.52 57.74 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.75 -0.463 . . . . 25.0 109.75 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.6 p -81.94 -8.87 59.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.1 32.01 12.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.519 0.728 . . . . 25.0 110.292 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.94 36.83 24.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.557 1.317 . . . . 25.0 114.557 -176.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -119.82 133.31 55.64 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.927 0.491 . . . . 25.0 110.615 175.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.4 p -61.12 -33.08 72.81 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.126 1.158 . . . . 25.0 114.126 -175.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -66.24 -15.97 63.63 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.48 0.657 . . . . 25.0 112.076 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.698 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -117.25 14.31 14.78 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.744 -0.835 . . . . 25.0 108.744 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -71.16 -38.76 72.17 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.895 -1.128 . . . . 25.0 111.325 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.3 mp0 -71.31 -13.66 61.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.803 0.811 . . . . 25.0 109.677 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -88.02 -4.65 58.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.693 -0.854 . . . . 25.0 108.693 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -113.11 -32.58 6.28 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.842 0.682 . . . . 25.0 112.842 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -97.09 123.08 40.75 Favored 'General case' 0 CA--C 1.507 -0.71 0 O-C-N 121.534 -0.729 . . . . 25.0 109.845 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.44 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -124.96 160.94 27.75 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.193 -0.912 . . . . 25.0 110.006 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -119.01 161.14 37.97 Favored Pre-proline 0 C--N 1.317 -0.815 1 N-CA-C 100.087 -4.042 . . . . 25.0 100.087 163.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.41 -5.31 15.68 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 116.924 -1.584 . . . . 25.0 115.64 -174.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.6 t -124.64 10.73 8.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.198 0.523 . . . . 25.0 111.7 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -78.17 -30.14 48.95 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.726 -0.609 . . . . 25.0 112.474 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.0 m95 -123.74 165.4 17.33 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.536 0.208 . . . . 25.0 110.646 -177.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -68.12 128.51 36.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.79 -1.929 . . . . 25.0 105.79 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.5 mmtt -101.33 106.49 17.67 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 100.929 -3.73 . . . . 25.0 100.929 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.02 135.58 52.51 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.022 -0.99 . . . . 25.0 110.511 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -89.88 101.49 14.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.738 -1.119 . . . . 25.0 107.985 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -130.68 173.86 10.49 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.632 -1.247 . . . . 25.0 107.632 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -114.69 161.9 17.51 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.275 0.843 . . . . 25.0 113.275 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.445 HG21 ' HA ' ' A' ' 139' ' ' ALA . 71.3 p -78.15 172.49 13.47 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 106.593 -1.632 . . . . 25.0 106.593 171.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.37 -162.38 32.0 Favored Glycine 0 C--O 1.241 0.562 0 N-CA-C 110.825 -0.91 . . . . 25.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.62 129.91 34.67 Favored 'Trans proline' 0 C--N 1.345 0.382 0 CA-C-N 118.961 1.38 . . . . 25.0 114.514 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -138.71 160.11 40.44 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.6 p -106.44 152.34 23.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -135.82 100.93 4.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.475 -2.417 . . . . 25.0 104.475 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.89 106.99 18.02 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.304 -0.862 . . . . 25.0 110.446 -176.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -92.8 146.94 23.26 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.62 -0.718 . . . . 25.0 109.944 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -127.53 116.08 19.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 103.937 -2.616 . . . . 25.0 103.937 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -116.42 125.6 52.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.535 -0.757 . . . . 25.0 112.689 -173.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.4 t -87.62 5.33 40.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.314 0.578 . . . . 25.0 110.245 173.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.61 116.74 21.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.93 0.395 . . . . 25.0 110.366 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -79.84 2.88 21.47 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -178.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.92 153.18 42.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.698 -0.482 . . . . 25.0 109.698 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 156.01 39.72 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.533 0.938 . . . . 25.0 113.533 -172.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.0 t -99.64 158.91 15.43 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.215 -1.031 . . . . 25.0 108.215 174.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.91 -15.31 10.0 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.161 0.288 . . . . 25.0 111.25 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.6 t -171.89 153.21 3.18 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.939 0.4 . . . . 25.0 111.951 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -125.72 139.66 53.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 104.404 -2.443 . . . . 25.0 104.404 167.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -145.01 151.42 38.54 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.342 -0.984 . . . . 25.0 108.342 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -138.01 135.04 35.55 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.12 161.71 41.42 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 118.35 0.523 . . . . 25.0 109.973 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.34 162.59 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 113.757 1.021 . . . . 25.0 113.757 -167.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -76.74 161.23 28.66 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.648 -1.242 . . . . 25.0 107.648 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.93 157.52 40.16 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.147 -0.933 . . . . 25.0 110.202 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -67.75 -19.7 47.0 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 117.858 -0.961 . . . . 25.0 114.285 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -120.98 31.99 6.16 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 122.819 0.448 . . . . 25.0 111.64 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.72 163.99 27.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.942 0.877 . . . . 25.0 112.942 -176.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.33 101.02 11.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.433 -1.258 . . . . 25.0 110.348 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -86.5 17.35 3.89 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.828 2.158 . . . . 25.0 116.828 -169.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.8 t -125.4 6.72 7.68 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.689 0.757 . . . . 25.0 109.315 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -107.72 158.45 33.35 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.7 -1.137 . . . . 25.0 108.416 -173.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -66.53 156.12 66.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 O-C-N 121.961 0.453 . . . . 25.0 111.812 178.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -70.33 100.1 1.67 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.123 0.487 . . . . 25.0 112.033 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.6 p -93.51 152.72 18.87 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.648 -1.241 . . . . 25.0 107.648 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -66.14 -25.19 66.86 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.745 -0.597 . . . . 25.0 111.073 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.29 65.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.306 -0.861 . . . . 25.0 112.235 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.5 t -82.02 -5.51 58.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.319 0.489 . . . . 25.0 112.319 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -103.87 154.24 19.84 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 114.673 1.36 . . . . 25.0 114.673 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -94.87 95.65 8.81 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 103.013 -2.958 . . . . 25.0 103.013 163.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.97 -7.03 19.29 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.109 1.152 . . . . 25.0 114.109 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.68 118.75 73.39 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.89 -0.781 . . . . 25.0 108.89 176.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.36 141.31 42.49 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 115.403 -2.598 . . . . 25.0 111.804 179.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -89.98 -12.97 37.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.523 0.564 . . . . 25.0 112.523 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.6 m -149.11 66.11 1.03 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.488 -0.324 . . . . 25.0 111.259 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -88.99 132.52 34.69 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.749 -1.181 . . . . 25.0 109.018 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -123.03 99.19 6.25 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.664 -2.347 . . . . 25.0 104.664 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -90.27 92.06 8.76 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.418 -1.327 . . . . 25.0 107.418 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -104.48 118.17 35.94 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.979 -1.489 . . . . 25.0 106.979 177.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.84 80.53 0.4 Allowed Glycine 0 CA--C 1.503 -0.696 0 CA-C-N 115.396 -0.82 . . . . 25.0 113.48 -170.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.47 15.18 6.03 Favored Glycine 0 C--N 1.322 -0.25 0 C-N-CA 120.916 -0.659 . . . . 25.0 113.661 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.48 104.82 5.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.563 0.697 . . . . 25.0 109.689 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.38 123.23 89.26 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 106.092 -1.818 . . . . 25.0 106.092 176.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.68 161.39 44.06 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 118.352 -0.632 . . . . 25.0 113.739 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.58 26.61 3.38 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.965 -1.124 . . . . 25.0 107.965 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.13 -15.45 0.41 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.975 1.71 . . . . 25.0 111.947 -174.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -129.43 151.01 50.53 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 103.776 -2.675 . . . . 25.0 103.776 169.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.46 95.0 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 122.382 1.087 . . . . 25.0 108.633 -178.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.8 m -87.36 124.72 33.69 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -118.4 162.44 18.32 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 105.27 -2.122 . . . . 25.0 105.27 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -133.95 146.35 50.4 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 103.81 -2.663 . . . . 25.0 103.81 171.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.22 158.81 27.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.986 -1.116 . . . . 25.0 107.986 -176.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -102.13 117.0 33.86 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.119 0.262 . . . . 25.0 110.67 -177.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.5 mt -75.31 132.13 76.72 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 107.238 -1.393 . . . . 25.0 107.238 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.89 145.93 96.7 Favored 'Trans proline' 0 C--N 1.352 0.742 0 CA-C-O 121.753 0.647 . . . . 25.0 113.492 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.445 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.11 -25.83 39.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.093 -0.958 . . . . 25.0 112.48 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -84.01 9.12 13.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.697 -0.683 . . . . 25.0 110.165 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -116.0 51.26 0.97 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.837 0.827 . . . . 25.0 108.966 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.9 p -86.11 165.2 16.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.868 -1.53 . . . . 25.0 106.868 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.29 -169.09 32.83 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 114.541 0.576 . . . . 25.0 114.541 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.0 114.36 22.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.433 0.635 . . . . 25.0 111.116 -168.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.96 170.46 21.3 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.725 -0.671 . . . . 25.0 110.657 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -105.85 150.61 8.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 107.406 -1.331 . . . . 25.0 107.406 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 50.1 mt -131.45 120.21 45.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.214 -2.143 . . . . 25.0 105.214 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.78 130.07 49.64 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.453 -0.794 . . . . 25.0 109.545 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -116.66 129.74 56.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.72 140.18 48.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.154 0.978 . . . . 25.0 112.028 -177.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -114.53 117.36 30.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 106.43 -1.693 . . . . 25.0 106.43 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.08 126.49 42.28 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.5 mm -81.79 141.62 14.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.453 -0.573 . . . . 25.0 109.453 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.58 -42.39 22.37 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.767 0.712 . . . . 25.0 110.394 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.09 -24.08 65.0 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.583 0.957 . . . . 25.0 113.583 -172.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.7 p -139.32 170.54 15.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.966 0.889 . . . . 25.0 110.21 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.22 23.64 0.58 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.125 -0.943 . . . . 25.0 112.21 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -94.32 147.48 23.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.691 -0.631 . . . . 25.0 112.606 -176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.19 143.24 12.08 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.053 -2.203 . . . . 25.0 105.053 172.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -146.66 136.03 22.82 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.997 0.74 . . . . 25.0 112.997 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -93.98 114.8 27.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.524 -0.762 . . . . 25.0 111.54 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -97.05 113.37 24.91 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.21 140.71 29.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.043 -0.526 . . . . 25.0 112.051 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.5 tt -125.13 135.47 63.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.787 -1.931 . . . . 25.0 105.787 167.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -95.31 131.2 41.67 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.766 -1.198 . . . . 25.0 107.766 176.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.5 m -132.76 163.23 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 113.103 0.779 . . . . 25.0 113.103 -175.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -119.53 95.04 4.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 104.386 -2.45 . . . . 25.0 104.386 167.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.3 tp -90.03 163.96 14.7 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 112.689 0.625 . . . . 25.0 112.689 -172.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.5 p -144.33 156.74 44.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.153 -1.054 . . . . 25.0 108.153 175.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.379 -0.82 . . . . 25.0 112.416 -175.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.7 m170 . . . . . 0 N--CA 1.484 1.237 0 CA-C-O 121.372 0.606 . . . . 25.0 110.761 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.26 168.76 34.14 Favored Glycine 0 N--CA 1.451 -0.32 1 N-CA-C 100.85 -4.9 . . . . 25.0 100.85 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -146.69 162.64 38.06 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 120.374 2.087 . . . . 25.0 110.507 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -99.34 122.6 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.979 -1.119 . . . . 25.0 107.979 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -73.42 -42.95 61.41 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.801 -1.09 . . . . 25.0 109.593 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -152.62 129.56 5.61 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 106.129 -1.804 . . . . 25.0 106.129 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.67 133.37 16.49 Favored 'Cis proline' 0 CA--C 1.534 0.495 0 C-N-CA 128.577 0.657 . . . . 25.0 111.476 -0.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.52 110.72 3.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 25.0 112.409 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 156.81 38.74 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.275 -0.639 . . . . 25.0 109.275 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -56.3 -24.77 45.54 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.642 0.777 . . . . 25.0 112.656 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.99 -49.89 58.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.771 0.796 . . . . 25.0 109.066 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -66.22 -37.43 85.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.468 -0.787 . . . . 25.0 109.888 177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -63.17 -33.1 74.73 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 122.258 -0.276 . . . . 25.0 110.808 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -39.07 91.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 25.0 110.235 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.447 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -67.67 -35.92 79.76 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.565 -0.531 . . . . 25.0 109.565 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.9 mt -77.37 4.09 11.65 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.21 -0.45 . . . . 25.0 111.599 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 58.19 22.44 9.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.306 1.443 . . . . 25.0 113.265 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.1 mt -85.03 -21.09 29.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.242 -1.392 . . . . 25.0 107.242 173.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -124.04 158.16 32.81 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.2 p -136.77 175.34 9.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.112 -0.329 . . . . 25.0 110.112 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 72.11 4.91 5.17 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.423 1.638 . . . . 25.0 115.423 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -66.63 -38.26 86.55 Favored 'General case' 0 CA--C 1.501 -0.918 0 O-C-N 121.823 -0.548 . . . . 25.0 110.972 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -63.49 1.42 Allowed Glycine 0 C--O 1.218 -0.854 0 O-C-N 123.753 0.658 . . . . 25.0 112.271 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.9 t -87.81 -54.35 4.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.571 1.177 . . . . 25.0 111.37 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.445 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.2 OUTLIER -68.83 -7.01 6.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.236 -1.347 . . . . 25.0 113.82 -171.686 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.437 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.9 pt20 -91.51 0.3 57.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.848 -0.533 . . . . 25.0 111.261 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -116.02 -34.08 4.85 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.904 -0.719 . . . . 25.0 109.893 173.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -126.91 101.75 25.83 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 109.284 -0.636 . . . . 25.0 109.284 169.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.447 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 98.0 Cg_endo -73.24 -20.4 21.37 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 117.108 -1.461 . . . . 25.0 114.53 -174.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -86.17 11.87 10.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.338 0.495 . . . . 25.0 112.338 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.1 m -65.18 -12.42 50.96 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.1 130.24 28.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 122.135 0.969 . . . . 25.0 112.919 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -152.96 151.07 29.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 104.975 -2.232 . . . . 25.0 104.975 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.65 -169.38 22.89 Favored Glycine 0 C--O 1.229 -0.216 0 N-CA-C 109.755 -1.338 . . . . 25.0 109.755 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.42 147.83 49.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 118.051 0.926 . . . . 25.0 111.725 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -65.99 157.04 31.87 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.883 -1.154 . . . . 25.0 107.883 172.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.58 -4.01 1.66 Allowed Glycine 0 C--N 1.317 -0.494 0 CA-C-N 114.773 -1.103 . . . . 25.0 112.91 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -75.76 144.58 76.9 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 121.689 -0.889 . . . . 25.0 109.116 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -91.54 -17.86 14.83 Favored 'Cis proline' 0 CA--C 1.543 0.962 0 N-CA-C 116.041 1.516 . . . . 25.0 116.041 -5.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.6 -37.44 62.88 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.913 1.449 . . . . 25.0 114.913 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -116.47 32.29 6.22 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.212 -1.773 . . . . 25.0 106.212 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.59 -176.94 47.0 Favored Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 114.591 -1.186 . . . . 25.0 110.744 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.95 171.54 3.68 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.982 2.455 . . . . 25.0 113.095 177.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.11 160.07 30.9 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.726 -1.213 . . . . 25.0 107.726 174.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.75 139.62 57.14 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 106.038 -1.838 . . . . 25.0 106.038 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 106' ' ' PRO . . . 86.4 -8.02 76.33 Favored Glycine 0 C--O 1.229 -0.163 0 CA-C-N 116.403 -0.362 . . . . 25.0 112.666 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -126.18 9.5 7.37 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.396 -0.473 . . . . 25.0 111.329 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.86 -49.53 83.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 122.151 -0.343 . . . . 25.0 111.166 -174.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -20.9 57.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.98 0.419 . . . . 25.0 110.266 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -84.73 -8.57 58.79 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.995 0.739 . . . . 25.0 112.995 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 33.31 13.65 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.53 0.732 . . . . 25.0 110.043 -172.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.47 39.24 25.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.816 1.414 . . . . 25.0 114.816 -177.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -120.55 137.55 54.33 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.105 0.562 . . . . 25.0 110.714 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.0 p -62.95 -36.28 82.95 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 115.617 1.71 . . . . 25.0 115.617 -173.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 t -72.29 -5.01 33.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -177.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.702 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -121.14 12.5 11.08 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -72.23 -36.5 69.12 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.051 -1.031 . . . . 25.0 110.106 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -71.69 -11.07 60.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.496 -0.774 . . . . 25.0 109.715 175.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.0 mp -93.95 -1.3 54.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.822 -0.807 . . . . 25.0 108.822 -177.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -116.26 -32.02 5.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.567 0.58 . . . . 25.0 112.567 174.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -92.22 131.77 37.19 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 107.453 -1.314 . . . . 25.0 107.453 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.476 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.3 pm0 -137.56 160.61 38.69 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.405 -0.816 . . . . 25.0 111.443 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 52.8 p -119.99 159.57 46.42 Favored Pre-proline 0 C--O 1.242 0.667 1 N-CA-C 100.068 -4.049 . . . . 25.0 100.068 159.968 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -70.32 -6.37 18.72 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 116.281 -2.012 . . . . 25.0 115.558 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.2 t -114.5 2.1 14.51 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.636 0.606 . . . . 25.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -78.33 -28.13 47.26 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.088 0.773 . . . . 25.0 113.088 -175.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.476 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.5 m95 -124.5 163.13 22.5 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 120.581 0.229 . . . . 25.0 110.608 -177.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.31 129.49 40.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 106.158 -1.793 . . . . 25.0 106.158 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -101.86 107.56 18.78 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 100.231 -3.989 . . . . 25.0 100.231 177.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -68.37 134.48 50.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.242 -0.89 . . . . 25.0 110.141 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -92.63 100.78 13.23 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 25.0 108.0 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.5 mt -131.17 173.99 10.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.106 -1.072 . . . . 25.0 108.106 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.23 154.33 25.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 111.519 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.445 HG22 HD23 ' A' ' 168' ' ' LEU . 58.9 p -77.04 168.37 20.2 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 96.61 -161.86 22.2 Favored Glycine 0 C--O 1.241 0.564 0 N-CA-C 110.366 -1.094 . . . . 25.0 110.366 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.95 132.29 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 CA-C-N 119.057 1.429 . . . . 25.0 113.482 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.94 160.76 38.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.473 -1.677 . . . . 25.0 106.473 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 p -101.37 151.1 22.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.686 -1.227 . . . . 25.0 107.686 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -138.02 100.97 4.3 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.074 -2.195 . . . . 25.0 105.074 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.07 114.33 28.15 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.356 -0.838 . . . . 25.0 110.038 -176.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -101.5 150.96 22.53 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.526 -0.761 . . . . 25.0 110.631 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -126.63 116.46 21.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 104.092 -2.559 . . . . 25.0 104.092 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.76 126.64 55.64 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.547 -0.751 . . . . 25.0 110.952 -174.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.3 t -89.01 13.9 11.85 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.44 0.638 . . . . 25.0 110.565 176.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -133.68 138.75 46.03 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.94 -0.475 . . . . 25.0 109.855 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -86.09 -7.67 58.43 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.681 0.623 . . . . 25.0 112.681 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.77 157.92 31.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.4 t -76.98 156.0 32.22 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 114.809 1.411 . . . . 25.0 114.809 -172.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -97.14 159.41 14.93 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 172.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -117.81 -14.54 10.11 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 123.127 0.267 . . . . 25.0 111.263 171.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -172.19 152.85 2.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.947 0.403 . . . . 25.0 111.335 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -125.43 136.91 53.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 167.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -142.04 150.19 40.94 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.044 -1.095 . . . . 25.0 108.044 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -136.57 133.6 36.56 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.03 164.14 35.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.334 0.515 . . . . 25.0 110.595 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.91 164.81 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.331 0.863 . . . . 25.0 113.331 -166.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.6 p -81.33 162.92 23.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.286 -1.375 . . . . 25.0 107.286 168.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -61.27 157.71 42.21 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.468 -0.787 . . . . 25.0 108.996 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -69.0 -22.33 35.75 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 116.464 -1.891 . . . . 25.0 114.021 -173.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -114.05 31.9 6.24 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.322 0.49 . . . . 25.0 112.322 -173.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.506 ' HE1' ' HA ' ' A' ' 145' ' ' HIS . 5.5 p-90 -80.42 163.31 23.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.527 0.68 . . . . 25.0 110.106 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -87.28 101.08 13.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.309 -0.86 . . . . 25.0 110.324 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.19 22.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 115.253 1.575 . . . . 25.0 115.253 -174.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.1 t -118.93 1.09 11.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.565 0.697 . . . . 25.0 109.852 175.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -112.51 160.0 32.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 107.937 -1.135 . . . . 25.0 107.937 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' PRO . . . . . 0.417 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 58.1 Cg_endo -64.36 159.48 43.67 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 120.431 0.754 . . . . 25.0 112.592 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.4 mp -68.12 117.12 9.54 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 122.189 -0.32 . . . . 25.0 110.293 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.5 p -114.41 150.59 34.45 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.578 -0.897 . . . . 25.0 108.578 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.8 ptp180 -64.57 -24.9 67.75 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.977 -0.452 . . . . 25.0 111.621 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.54 72.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.699 -0.682 . . . . 25.0 111.999 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 85.0 p -88.98 -3.01 58.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.111 -0.495 . . . . 25.0 111.978 -178.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -97.28 150.81 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.941 1.46 . . . . 25.0 114.941 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.23 96.15 8.22 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 102.883 -3.006 . . . . 25.0 102.883 162.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.26 0.63 7.52 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.142 1.164 . . . . 25.0 114.142 -171.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 10.2 t -98.19 134.46 22.01 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.197 -0.668 . . . . 25.0 109.197 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 146.81 37.99 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 116.447 -1.902 . . . . 25.0 112.29 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -97.1 -6.63 34.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.995 0.426 . . . . 25.0 111.335 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 36.0 m -151.71 71.61 0.99 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -88.88 131.35 35.15 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 119.172 -1.011 . . . . 25.0 109.628 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -122.03 99.06 6.23 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 103.465 -2.791 . . . . 25.0 103.465 176.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -92.8 91.95 7.71 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.433 -1.321 . . . . 25.0 107.433 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -113.74 118.56 34.66 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.81 81.8 0.36 Allowed Glycine 0 CA--C 1.501 -0.841 0 CA-C-N 115.551 -0.749 . . . . 25.0 112.901 -170.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.47 16.06 5.24 Favored Glycine 0 C--N 1.32 -0.342 0 C-N-CA 120.931 -0.652 . . . . 25.0 113.699 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.88 104.03 4.61 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.579 0.704 . . . . 25.0 109.449 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.7 126.23 90.82 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 106.376 -1.712 . . . . 25.0 106.376 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.09 171.13 18.91 Favored 'Trans proline' 0 C--N 1.344 0.294 0 N-CA-C 113.573 0.566 . . . . 25.0 113.573 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.438 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.55 29.84 5.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.687 -1.227 . . . . 25.0 107.687 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.08 -15.04 0.35 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.894 1.678 . . . . 25.0 111.868 -173.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.438 ' H ' ' C ' ' A' ' 128' ' ' ALA . 68.4 mt-30 -129.0 154.69 46.37 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 103.416 -2.809 . . . . 25.0 103.416 170.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.4 t -140.48 94.98 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.577 0 N-CA-C 106.266 -1.753 . . . . 25.0 106.266 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.14 145.57 27.56 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 104.43 -2.433 . . . . 25.0 104.43 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.04 166.98 31.8 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.493 -1.685 . . . . 25.0 108.217 -178.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -136.14 154.3 51.02 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.95 160.55 30.92 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.769 -1.567 . . . . 25.0 106.769 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -103.38 115.55 30.76 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.018 0.199 . . . . 25.0 111.004 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.71 130.33 73.89 Favored Pre-proline 0 C--O 1.239 0.519 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.69 147.22 95.02 Favored 'Trans proline' 0 C--N 1.351 0.683 0 CA-C-O 121.729 0.637 . . . . 25.0 113.232 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.95 -24.22 38.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.188 -0.915 . . . . 25.0 112.554 -169.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.4 p-10 -85.02 9.57 14.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.65 -0.705 . . . . 25.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -113.51 56.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.864 -1.161 . . . . 25.0 107.864 170.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.2 p -86.18 170.79 11.83 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 106.968 -1.493 . . . . 25.0 106.968 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 82.25 -165.42 44.94 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 116.926 1.53 . . . . 25.0 116.926 174.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.4 t -86.04 106.47 17.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.295 0.569 . . . . 25.0 110.962 -168.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.506 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.6 p-80 -157.96 172.43 18.46 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.082 -0.508 . . . . 25.0 111.306 -176.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.8 p -102.87 150.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.786 -1.19 . . . . 25.0 107.786 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.9 mt -134.84 129.6 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 N-CA-C 101.487 -3.523 . . . . 25.0 101.487 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -120.28 139.71 52.31 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 109.78 -0.452 . . . . 25.0 109.78 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -120.6 134.26 55.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.073 -0.714 . . . . 25.0 109.073 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.25 139.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 122.165 0.983 . . . . 25.0 112.02 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -109.45 113.2 25.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.299 -1.741 . . . . 25.0 106.299 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 122.22 35.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.735 -1.209 . . . . 25.0 107.735 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.8 mm -78.52 142.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.388 -0.597 . . . . 25.0 109.388 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.23 -43.19 24.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.819 0.736 . . . . 25.0 110.224 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.01 -23.47 65.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.755 -1.111 . . . . 25.0 113.898 -172.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.0 p -139.82 170.4 15.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.045 0.926 . . . . 25.0 110.299 -175.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.6 20.04 0.96 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.115 -0.948 . . . . 25.0 112.232 177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.13 146.07 24.57 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.617 -0.677 . . . . 25.0 112.491 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.41 143.46 11.87 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.385 -2.08 . . . . 25.0 105.385 172.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -146.6 130.9 17.53 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 111.772 0.286 . . . . 25.0 111.772 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -88.95 115.76 26.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.868 -0.605 . . . . 25.0 110.663 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.02 20.67 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.691 -0.855 . . . . 25.0 108.691 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.68 143.43 33.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 25.0 112.552 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -129.0 134.94 63.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 105.135 -2.172 . . . . 25.0 105.135 166.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -94.45 130.93 40.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.84 162.26 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 112.973 0.731 . . . . 25.0 112.973 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -120.38 95.12 4.6 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.362 -2.459 . . . . 25.0 104.362 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.445 HD23 HG22 ' A' ' 74' ' ' THR . 1.9 tp -90.5 162.81 14.88 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 113.274 0.842 . . . . 25.0 113.274 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.3 p -145.26 164.42 31.46 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.72 0 CA-C-O 117.966 -1.016 . . . . 25.0 110.785 -178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.2 m80 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.328 0.585 . . . . 25.0 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.59 169.79 38.38 Favored Glycine 0 CA--C 1.508 -0.357 1 N-CA-C 102.54 -4.224 . . . . 25.0 102.54 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 p90 -144.16 160.01 41.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 119.954 1.877 . . . . 25.0 110.461 178.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.24 121.14 47.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.48 -40.94 56.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.515 -1.22 . . . . 25.0 109.972 -174.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.6 t -153.7 128.68 4.88 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 105.77 -1.937 . . . . 25.0 105.77 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.19 130.6 11.28 Favored 'Cis proline' 0 C--N 1.348 0.512 0 C-N-CA 128.554 0.648 . . . . 25.0 111.099 -0.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 114.48 5.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.106 -0.497 . . . . 25.0 112.263 -172.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.1 t -71.86 158.64 35.69 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 108.628 -0.878 . . . . 25.0 108.628 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -54.6 -26.33 31.93 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.578 0.751 . . . . 25.0 111.81 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.97 -53.45 38.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.678 0.752 . . . . 25.0 109.327 175.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.09 -34.86 78.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.733 -0.667 . . . . 25.0 110.558 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -63.45 -33.14 74.9 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 122.174 -0.329 . . . . 25.0 110.548 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -40.03 95.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.319 0.581 . . . . 25.0 109.617 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.422 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -68.3 -33.85 75.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.081 -0.509 . . . . 25.0 110.395 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.91 5.21 14.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.454 176.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 58.83 23.23 11.05 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.098 1.359 . . . . 25.0 113.053 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.44 -21.24 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.818 -1.178 . . . . 25.0 107.818 174.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.9 m-20 -124.31 160.17 28.65 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.687 -2.338 . . . . 25.0 104.687 176.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -136.42 174.8 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.247 -0.279 . . . . 25.0 110.247 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 71.8 5.26 5.31 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.917 1.821 . . . . 25.0 115.917 173.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.3 m -67.35 -35.2 78.89 Favored 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 121.555 -0.716 . . . . 25.0 111.045 174.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.4 -64.3 1.38 Allowed Glycine 0 C--O 1.217 -0.918 0 O-C-N 123.818 0.699 . . . . 25.0 112.185 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 t -87.89 -54.09 4.42 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.621 1.2 . . . . 25.0 111.176 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.73 -8.27 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.151 -1.386 . . . . 25.0 113.164 -171.591 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.81 1.75 54.73 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.976 -0.453 . . . . 25.0 111.505 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.51 -34.88 3.68 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.713 -0.795 . . . . 25.0 110.427 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -127.12 100.57 26.77 Favored Pre-proline 0 C--O 1.241 0.636 0 C-N-CA 122.132 0.173 . . . . 25.0 111.163 169.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.422 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.2 Cg_endo -74.05 -21.28 18.36 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 117.141 -1.439 . . . . 25.0 114.505 -176.241 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -83.83 11.98 6.75 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.697 0.629 . . . . 25.0 112.697 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -68.99 -16.22 63.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.739 0.304 . . . . 25.0 111.77 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.68 137.69 24.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 113.983 1.105 . . . . 25.0 113.983 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -152.97 152.99 32.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 106.156 -1.794 . . . . 25.0 106.156 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -155.34 -168.31 18.27 Favored Glycine 0 C--O 1.229 -0.206 0 N-CA-C 108.694 -1.763 . . . . 25.0 108.694 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.6 tp -127.8 147.31 50.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 118.325 1.063 . . . . 25.0 111.704 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -66.47 156.89 33.52 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 172.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 1.84 3.84 Favored Glycine 0 C--O 1.225 -0.43 0 CA-C-N 114.962 -1.017 . . . . 25.0 113.255 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.95 145.1 77.05 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 121.732 -0.864 . . . . 25.0 109.691 -176.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -91.63 -16.07 18.36 Favored 'Cis proline' 0 CA--C 1.54 0.823 0 N-CA-C 115.119 1.161 . . . . 25.0 115.119 -6.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -71.8 -35.68 70.06 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.711 1.374 . . . . 25.0 114.711 -169.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.43 30.97 6.99 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.508 -2.034 . . . . 25.0 105.508 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.31 -173.43 40.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 114.259 -1.337 . . . . 25.0 111.131 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.11 171.61 4.91 Favored 'Trans proline' 0 C--O 1.242 0.685 0 C-N-CA 123.099 2.532 . . . . 25.0 113.713 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.01 159.94 31.15 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.649 -1.612 . . . . 25.0 106.649 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.42 138.81 58.27 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.385 -1.28 . . . . 25.0 107.864 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.83 -4.32 82.89 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-O 121.408 0.449 . . . . 25.0 112.794 -174.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -124.19 10.23 8.69 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.171 -0.678 . . . . 25.0 109.171 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.0 mt -65.32 -50.16 74.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 122.361 -0.212 . . . . 25.0 111.509 -173.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.64 -20.35 58.56 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.811 -0.556 . . . . 25.0 110.124 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.0 p -83.54 -8.27 59.37 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.434 0.531 . . . . 25.0 112.434 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.42 34.02 14.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.627 0.771 . . . . 25.0 110.168 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.07 39.74 25.96 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.734 1.383 . . . . 25.0 114.734 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -120.74 134.4 55.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.174 0.59 . . . . 25.0 110.752 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -62.38 -34.34 76.51 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.698 1.37 . . . . 25.0 114.698 -175.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 t -70.49 -8.33 50.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.488 0.551 . . . . 25.0 112.488 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.693 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -120.84 13.76 11.53 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.479 -1.304 . . . . 25.0 107.479 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -72.4 -37.18 68.75 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.056 -1.028 . . . . 25.0 110.455 -176.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -71.45 -13.7 61.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.721 0.772 . . . . 25.0 109.084 174.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.693 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.3 mp -90.17 -3.78 57.66 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.673 -0.694 . . . . 25.0 109.142 -178.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -113.95 -34.21 5.5 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -92.82 119.91 32.64 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 121.596 -0.69 . . . . 25.0 110.312 -178.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.484 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.14 160.96 25.38 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.213 -0.903 . . . . 25.0 108.888 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.8 p -117.77 162.67 27.88 Favored Pre-proline 0 C--N 1.316 -0.857 1 N-CA-C 99.671 -4.196 . . . . 25.0 99.671 162.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.84 -4.91 14.29 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 116.782 -1.679 . . . . 25.0 115.687 -175.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -125.54 11.53 7.97 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.228 0.537 . . . . 25.0 111.783 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -77.46 -28.21 52.33 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.868 0.692 . . . . 25.0 112.868 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.484 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.5 m95 -125.88 165.41 18.78 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 110.145 -0.317 . . . . 25.0 110.145 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -66.87 126.54 29.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.23 -2.137 . . . . 25.0 105.23 168.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -94.86 104.89 16.79 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 100.294 -3.965 . . . . 25.0 100.294 177.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.79 134.87 54.03 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.654 -1.157 . . . . 25.0 110.098 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -93.26 99.37 11.93 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.585 -1.265 . . . . 25.0 107.585 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.9 mt -129.68 173.83 10.26 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.669 -1.975 . . . . 25.0 105.669 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -116.73 163.35 16.27 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -178.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.437 HG22 HD23 ' A' ' 168' ' ' LEU . 73.8 p -77.48 172.88 12.65 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.653 -1.612 . . . . 25.0 107.086 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.54 -162.62 31.94 Favored Glycine 0 C--O 1.24 0.479 0 N-CA-C 111.125 -0.79 . . . . 25.0 111.125 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.13 130.25 35.44 Favored 'Trans proline' 0 C--N 1.346 0.418 0 CA-C-N 118.8 1.3 . . . . 25.0 113.667 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -137.52 158.59 44.06 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.51 -1.663 . . . . 25.0 106.51 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 p -96.22 150.31 20.68 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -135.3 100.94 4.67 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 104.512 -2.403 . . . . 25.0 104.512 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.72 114.64 28.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.911 0.862 . . . . 25.0 109.521 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -100.08 146.99 26.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.3 -0.864 . . . . 25.0 109.492 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.31 114.39 18.19 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 103.624 -2.732 . . . . 25.0 103.624 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.8 mp -111.93 133.15 54.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.596 -0.729 . . . . 25.0 110.83 -172.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -99.19 17.85 18.92 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.763 0.792 . . . . 25.0 109.049 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.58 133.74 50.99 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.201 -0.666 . . . . 25.0 109.201 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -87.27 -17.21 33.06 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.535 0.939 . . . . 25.0 113.535 -177.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.1 162.05 29.91 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.956 0.724 . . . . 25.0 112.956 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -66.41 155.93 36.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 116.508 2.04 . . . . 25.0 116.508 -170.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 8.2 t -101.37 158.98 15.66 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.694 -1.225 . . . . 25.0 107.694 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -117.94 -17.22 9.79 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.302 0.482 . . . . 25.0 112.302 172.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.9 t -171.09 154.38 4.06 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.503 0.556 . . . . 25.0 112.503 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.8 m95 -128.8 140.71 51.58 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 104.64 -2.355 . . . . 25.0 104.64 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.6 mtt-85 -147.43 151.7 36.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.39 -0.967 . . . . 25.0 108.39 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -137.93 138.72 39.27 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.114 -1.439 . . . . 25.0 107.114 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.66 162.77 39.56 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.284 0.493 . . . . 25.0 109.92 176.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.99 164.96 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 114.275 1.213 . . . . 25.0 114.275 -167.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 11.0 p -79.6 161.65 25.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.226 -1.027 . . . . 25.0 108.226 169.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.65 157.47 47.7 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.116 -0.947 . . . . 25.0 109.621 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.77 -18.44 36.96 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 117.444 -1.237 . . . . 25.0 114.072 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.73 31.93 6.21 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 122.791 0.436 . . . . 25.0 111.566 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -74.25 162.88 28.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.847 0.832 . . . . 25.0 111.434 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -83.64 101.06 11.24 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.736 -1.12 . . . . 25.0 110.172 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -84.81 14.09 5.16 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 116.597 2.073 . . . . 25.0 116.597 -171.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -117.93 1.91 12.1 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.833 -0.802 . . . . 25.0 108.833 175.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -105.09 158.48 32.0 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 107.832 -1.173 . . . . 25.0 107.832 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -66.65 159.44 51.0 Favored 'Trans proline' 0 C--N 1.344 0.327 0 O-C-N 122.024 0.486 . . . . 25.0 112.232 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.96 101.9 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 25.0 110.641 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.6 p -98.63 159.76 14.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.449 -0.945 . . . . 25.0 108.449 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -65.42 -25.76 67.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.097 0.475 . . . . 25.0 110.964 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -24.97 61.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.648 -0.706 . . . . 25.0 112.277 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.7 m -79.29 -12.1 59.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.754 0.311 . . . . 25.0 111.82 -178.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 42.2 m-85 -99.17 155.04 17.68 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.16 1.541 . . . . 25.0 115.16 -174.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -94.43 95.63 8.98 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 102.619 -3.104 . . . . 25.0 102.619 163.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.9 mt -69.79 20.89 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 116.428 2.011 . . . . 25.0 116.428 -169.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.0 t -114.3 137.39 22.52 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.272 -0.64 . . . . 25.0 109.272 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.77 152.07 46.91 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.208 -2.728 . . . . 25.0 111.196 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -107.9 -6.69 16.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.972 0.415 . . . . 25.0 111.688 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.5 m -152.6 70.06 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.133 -0.485 . . . . 25.0 109.911 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -89.06 135.06 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.239 -0.984 . . . . 25.0 109.172 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.01 99.12 5.98 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.765 -2.309 . . . . 25.0 104.765 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -93.24 92.06 7.55 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.931 -0.766 . . . . 25.0 108.931 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -107.42 117.06 33.1 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.671 -1.233 . . . . 25.0 107.671 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.55 80.58 0.37 Allowed Glycine 0 CA--C 1.503 -0.703 0 CA-C-N 115.799 -0.637 . . . . 25.0 113.519 -170.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.43 15.87 5.8 Favored Glycine 0 C--N 1.322 -0.237 0 C-N-CA 120.96 -0.638 . . . . 25.0 113.264 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.48 105.59 4.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.358 0.599 . . . . 25.0 109.585 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 88.8 mt -72.29 122.59 87.83 Favored Pre-proline 0 C--N 1.321 -0.673 0 N-CA-C 105.384 -2.08 . . . . 25.0 105.384 175.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.94 167.24 26.55 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 117.864 -0.957 . . . . 25.0 113.826 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.4 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -96.32 25.8 4.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.291 -1.003 . . . . 25.0 108.291 175.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.65 -12.36 0.46 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.822 1.649 . . . . 25.0 112.168 -174.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 128' ' ' ALA . 63.7 mt-30 -130.12 152.2 49.83 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.046 -2.576 . . . . 25.0 104.046 169.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.1 t -142.94 95.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.843 -1.54 . . . . 25.0 106.843 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -86.94 141.09 28.97 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.199 -2.148 . . . . 25.0 105.199 174.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.52 167.0 26.53 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.513 -2.032 . . . . 25.0 105.513 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -134.08 152.02 51.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.04 -2.208 . . . . 25.0 105.04 172.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.3 160.33 35.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.441 -1.318 . . . . 25.0 107.441 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -103.43 116.0 31.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.597 -0.274 . . . . 25.0 111.018 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 131.24 72.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -60.91 144.21 99.52 Favored 'Trans proline' 0 C--N 1.352 0.726 0 N-CA-C 113.919 0.7 . . . . 25.0 113.919 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.23 -28.2 42.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.182 -0.917 . . . . 25.0 112.514 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -82.35 10.25 7.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.733 0.778 . . . . 25.0 110.133 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -117.78 53.43 0.94 Allowed 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.553 -1.277 . . . . 25.0 107.553 171.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.95 11.82 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 106.398 -1.704 . . . . 25.0 106.398 174.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.95 -165.15 41.47 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 116.262 1.265 . . . . 25.0 116.262 176.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -86.02 108.61 18.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.446 0.641 . . . . 25.0 111.012 -168.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.408 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 44.0 p-80 -159.39 172.36 18.07 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.784 -0.644 . . . . 25.0 110.921 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -109.06 152.04 11.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.219 -1.03 . . . . 25.0 108.219 -179.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 67.8 mt -134.44 123.22 42.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 104.229 -2.508 . . . . 25.0 104.229 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.54 127.7 52.33 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 122.899 0.479 . . . . 25.0 110.261 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -111.54 129.36 56.08 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 108.816 -0.809 . . . . 25.0 108.816 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.7 p -126.72 139.75 50.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 122.172 0.987 . . . . 25.0 111.92 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 9.7 t90 -117.13 124.12 48.4 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.56 126.52 49.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.597 -0.52 . . . . 25.0 109.597 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 35.9 mm -77.85 142.47 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.93 -45.55 20.25 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.929 0.786 . . . . 25.0 110.678 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.17 -21.25 64.9 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.575 1.324 . . . . 25.0 114.575 -172.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 50.0 p -138.59 169.09 18.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.915 0.864 . . . . 25.0 109.577 -175.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.7 19.67 0.81 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.257 -0.883 . . . . 25.0 112.244 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.1 142.65 27.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -176.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.46 141.1 14.46 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 171.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -140.81 135.41 31.4 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.501 0.556 . . . . 25.0 112.501 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -93.65 112.47 24.35 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.449 -0.796 . . . . 25.0 111.149 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -97.15 108.21 20.89 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.971 -0.752 . . . . 25.0 108.971 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.11 141.75 33.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.744 -0.662 . . . . 25.0 111.737 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -125.27 132.88 70.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 105.553 -2.017 . . . . 25.0 105.553 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -96.46 129.42 43.83 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.3 162.31 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.666 0.987 . . . . 25.0 113.666 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.49 94.93 4.73 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.652 -2.721 . . . . 25.0 103.652 164.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.437 HD23 HG22 ' A' ' 74' ' ' THR . 2.9 tp -91.29 156.86 17.49 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 112.844 0.683 . . . . 25.0 112.844 -170.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.4 p -145.76 168.06 21.65 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.998 -0.439 . . . . 25.0 110.886 175.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.767 0 CA-C-O 118.711 -0.661 . . . . 25.0 110.602 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 121.012 0.434 . . . . 25.0 110.548 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.92 169.4 33.9 Favored Glycine 0 CA--C 1.509 -0.327 1 N-CA-C 101.872 -4.491 . . . . 25.0 101.872 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -145.75 161.49 39.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 120.188 1.994 . . . . 25.0 110.278 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -97.99 122.96 50.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.809 -1.182 . . . . 25.0 107.809 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -73.19 -43.34 61.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.999 -1.001 . . . . 25.0 109.424 -176.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.7 t -153.29 131.36 6.33 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.16 -1.793 . . . . 25.0 106.16 177.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.96 134.18 19.1 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.498 0.624 . . . . 25.0 111.395 -0.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.26 109.83 2.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.001 -0.545 . . . . 25.0 112.239 -172.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.6 t -71.94 157.55 37.63 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.947 -0.76 . . . . 25.0 108.947 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -55.86 -24.36 36.34 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.439 0.695 . . . . 25.0 111.812 178.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.54 -53.28 36.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.711 0.767 . . . . 25.0 109.279 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.01 -37.18 85.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.489 -0.778 . . . . 25.0 110.277 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -62.97 -32.82 74.23 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 120.991 -0.284 . . . . 25.0 110.814 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.05 94.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.086 0.47 . . . . 25.0 110.53 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.468 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.0 tmtm? -70.07 -33.42 71.9 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.05 0.452 . . . . 25.0 110.047 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.65 3.62 11.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.481 174.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.03 10.09 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.39 1.476 . . . . 25.0 113.05 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.8 mt -85.86 -22.28 27.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.196 -1.409 . . . . 25.0 107.196 173.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -123.3 158.78 30.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 105.004 -2.221 . . . . 25.0 105.004 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.6 p -135.95 177.76 7.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.463 -0.569 . . . . 25.0 109.463 -176.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 72.02 4.97 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.498 1.666 . . . . 25.0 115.498 173.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.4 m -69.95 -37.15 75.76 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.484 -0.76 . . . . 25.0 111.647 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.22 -63.5 1.72 Allowed Glycine 0 C--O 1.219 -0.838 0 O-C-N 123.474 0.484 . . . . 25.0 112.192 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.0 t -88.04 -53.33 4.78 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.392 1.092 . . . . 25.0 111.544 -178.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.9 OUTLIER -68.4 -10.56 13.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.447 -1.251 . . . . 25.0 113.054 -171.723 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -87.71 2.28 51.54 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.902 -0.499 . . . . 25.0 112.101 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -120.07 -34.74 3.62 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.756 -0.778 . . . . 25.0 110.677 172.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.05 105.32 22.32 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.288 -0.634 . . . . 25.0 109.288 169.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.468 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 86.9 Cg_endo -76.1 -20.23 14.93 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 116.326 -1.983 . . . . 25.0 114.16 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -85.0 12.11 8.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.555 0.576 . . . . 25.0 112.555 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -68.79 -12.13 61.15 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.859 0.361 . . . . 25.0 111.966 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.09 133.65 29.52 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.877 0.846 . . . . 25.0 112.734 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -152.85 153.93 34.08 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.882 -1.525 . . . . 25.0 106.882 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.53 -172.43 26.69 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 109.339 -1.504 . . . . 25.0 109.339 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.4 tp -124.28 151.49 44.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.848 0.824 . . . . 25.0 111.774 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -64.26 156.99 27.15 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.772 -1.196 . . . . 25.0 107.772 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.17 -2.68 3.25 Favored Glycine 0 C--O 1.223 -0.565 0 CA-C-N 114.517 -1.22 . . . . 25.0 113.028 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -75.76 138.89 69.89 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 121.407 -1.054 . . . . 25.0 110.522 -175.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -92.71 -15.76 16.73 Favored 'Cis proline' 0 CA--C 1.543 0.955 0 N-CA-C 115.609 1.35 . . . . 25.0 115.609 -6.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -71.05 -35.35 71.92 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.412 1.634 . . . . 25.0 115.412 -168.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.07 32.74 5.71 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.938 -1.875 . . . . 25.0 105.938 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.21 -174.28 40.57 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 114.407 -1.27 . . . . 25.0 111.496 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.98 170.87 4.28 Favored 'Trans proline' 0 C--O 1.241 0.637 0 C-N-CA 123.212 2.608 . . . . 25.0 113.359 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.13 159.96 31.03 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.2 -1.407 . . . . 25.0 107.2 174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.86 139.19 58.04 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.424 -1.262 . . . . 25.0 107.96 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.39 -5.66 76.34 Favored Glycine 0 C--O 1.23 -0.12 0 CA-C-O 121.704 0.613 . . . . 25.0 112.874 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 20.3 m170 -126.43 9.21 7.18 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 71.4 mt -65.96 -49.7 74.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.276 -0.265 . . . . 25.0 111.161 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.17 -21.26 58.89 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.842 -0.536 . . . . 25.0 109.774 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -83.4 -6.58 59.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.758 0.651 . . . . 25.0 112.758 -178.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.78 32.6 12.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.544 0.738 . . . . 25.0 110.209 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.45 35.78 22.97 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.636 1.347 . . . . 25.0 114.636 -177.258 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -120.56 141.19 50.51 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.999 0.52 . . . . 25.0 111.743 176.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -65.35 -35.27 80.47 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.0 -6.85 45.13 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.348 0.594 . . . . 25.0 112.353 -177.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.675 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -120.45 12.66 11.66 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 107.226 -1.398 . . . . 25.0 107.226 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -71.77 -36.02 70.23 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.893 -1.129 . . . . 25.0 110.112 -175.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -71.38 -14.47 62.18 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.834 0.826 . . . . 25.0 109.967 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.675 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.9 mp -87.48 -7.59 57.44 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.405 -0.961 . . . . 25.0 108.405 -178.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -112.35 -31.99 6.65 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 120.959 0.409 . . . . 25.0 112.006 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -94.94 122.1 37.23 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 121.66 -0.65 . . . . 25.0 109.898 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.439 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -130.0 160.97 32.02 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.423 -0.955 . . . . 25.0 108.423 177.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.4 p -117.05 163.6 22.32 Favored Pre-proline 0 C--N 1.32 -0.71 1 N-CA-C 99.778 -4.156 . . . . 25.0 99.778 162.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -2.29 9.46 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 116.473 -1.885 . . . . 25.0 115.936 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.4 t -128.03 11.1 6.5 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.512 0.673 . . . . 25.0 111.831 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -79.12 -29.19 43.05 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.179 -0.951 . . . . 25.0 113.549 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.439 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.2 m95 -125.71 166.88 15.97 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.957 -0.386 . . . . 25.0 109.957 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -66.55 118.58 10.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.842 -1.54 . . . . 25.0 106.842 172.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -92.4 103.65 16.06 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 100.624 -3.843 . . . . 25.0 100.624 176.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.18 135.03 53.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.8 -1.091 . . . . 25.0 110.195 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -92.88 99.96 12.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.562 -1.199 . . . . 25.0 107.799 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.8 mt -131.7 173.95 10.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.558 -1.645 . . . . 25.0 106.558 -175.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -114.79 163.22 15.81 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.929 1.085 . . . . 25.0 113.929 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.431 HG21 ' HA ' ' A' ' 139' ' ' ALA . 74.5 p -76.96 168.58 19.86 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.71 -161.14 24.7 Favored Glycine 0 C--O 1.24 0.514 0 N-CA-C 110.619 -0.993 . . . . 25.0 110.619 -178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.85 131.11 41.87 Favored 'Trans proline' 0 C--N 1.346 0.443 0 CA-C-N 119.1 1.45 . . . . 25.0 114.437 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -140.07 159.71 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.816 -1.55 . . . . 25.0 106.816 178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 p -105.84 150.9 25.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.751 -1.204 . . . . 25.0 107.751 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -137.34 100.89 4.37 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 105.083 -2.191 . . . . 25.0 105.083 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.03 116.83 32.73 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.909 0.862 . . . . 25.0 109.811 -176.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -103.26 150.54 23.63 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.635 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -127.76 115.41 18.64 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 103.964 -2.606 . . . . 25.0 103.964 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -116.04 124.38 50.31 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.009 0.744 . . . . 25.0 113.009 -172.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.1 t -88.23 -1.93 58.3 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.05 0.452 . . . . 25.0 110.59 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.16 119.97 37.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.4 mmm180 -84.3 -0.13 51.28 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.925 1.454 . . . . 25.0 114.925 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.13 155.39 39.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 117.741 0.246 . . . . 25.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.6 t -74.14 155.95 37.87 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 114.879 1.437 . . . . 25.0 114.879 -171.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 7.3 t -90.73 162.61 14.82 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.01 -0.995 . . . . 25.0 108.552 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -117.89 -14.52 10.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.922 -0.769 . . . . 25.0 108.922 168.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 t -175.2 154.41 1.75 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.006 0.431 . . . . 25.0 111.213 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.1 m95 -116.99 130.65 56.83 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.861 -2.644 . . . . 25.0 103.861 165.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 53.0 mtt-85 -133.59 147.46 51.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.953 -1.128 . . . . 25.0 107.953 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -137.37 132.24 33.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 106.627 -1.62 . . . . 25.0 106.627 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.99 164.86 33.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.368 0.531 . . . . 25.0 110.69 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 167.99 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 113.249 0.833 . . . . 25.0 113.249 -167.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.3 p -83.76 161.5 20.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.879 -1.156 . . . . 25.0 107.879 168.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -61.88 158.19 44.92 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.159 -0.928 . . . . 25.0 109.796 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.79 -18.34 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 117.557 -1.162 . . . . 25.0 114.739 -173.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -120.84 31.71 6.29 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.166 0.432 . . . . 25.0 112.166 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -76.34 165.17 25.23 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.653 0.74 . . . . 25.0 110.889 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -87.54 101.02 13.22 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.167 -0.924 . . . . 25.0 110.272 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -79.09 18.54 0.64 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 115.749 1.759 . . . . 25.0 115.749 -174.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -117.77 -2.46 11.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.328 -0.619 . . . . 25.0 109.328 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -101.67 157.4 33.75 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.367 -0.833 . . . . 25.0 108.91 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -66.63 157.66 59.77 Favored 'Trans proline' 0 C--N 1.346 0.441 0 O-C-N 121.94 0.442 . . . . 25.0 112.233 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.64 105.45 4.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.507 0.67 . . . . 25.0 111.174 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 68.3 p -99.34 157.07 16.66 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.008 -0.738 . . . . 25.0 109.008 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -65.95 -26.13 67.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.139 0.495 . . . . 25.0 110.873 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.96 -24.99 60.86 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.506 -0.77 . . . . 25.0 112.239 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.1 t -83.44 -11.1 57.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.985 0.421 . . . . 25.0 111.54 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -94.18 156.71 16.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.715 1.006 . . . . 25.0 113.715 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -97.21 96.12 8.21 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 102.826 -3.027 . . . . 25.0 102.826 162.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.37 -7.54 32.24 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.711 1.004 . . . . 25.0 113.711 -171.159 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.76 122.7 78.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 108.124 -1.065 . . . . 25.0 108.124 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.91 139.79 36.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.362 -2.625 . . . . 25.0 111.996 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -87.7 -15.56 36.77 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.392 0.516 . . . . 25.0 112.392 -175.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.5 m -149.31 66.68 1.02 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.427 -0.351 . . . . 25.0 110.668 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -89.09 139.23 30.68 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 118.426 -1.31 . . . . 25.0 109.336 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -118.19 100.93 7.84 Favored 'General case' 0 CA--C 1.496 -1.113 0 N-CA-C 101.225 -3.62 . . . . 25.0 101.225 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -88.56 92.12 9.07 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 105.571 -2.011 . . . . 25.0 105.571 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.83 117.64 33.36 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.736 -1.579 . . . . 25.0 106.736 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.97 81.12 0.51 Allowed Glycine 0 CA--C 1.5 -0.855 0 CA-C-N 115.441 -0.8 . . . . 25.0 111.798 -173.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.21 16.85 5.54 Favored Glycine 0 C--N 1.32 -0.33 0 C-N-CA 120.86 -0.686 . . . . 25.0 114.283 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.87 104.18 5.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.629 -0.878 . . . . 25.0 108.629 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -75.84 127.56 85.24 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 107.54 -1.281 . . . . 25.0 107.54 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.44 153.77 60.79 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 117.985 -0.877 . . . . 25.0 113.842 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -98.8 30.88 3.14 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.982 -1.488 . . . . 25.0 106.982 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 72.74 -18.8 0.33 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.041 1.737 . . . . 25.0 111.705 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -129.23 151.51 49.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 104.941 -2.244 . . . . 25.0 104.941 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 47.6 t -144.08 95.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.495 -1.298 . . . . 25.0 107.495 -178.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -91.42 133.7 35.25 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 163.22 31.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 104.975 -2.231 . . . . 25.0 104.975 177.207 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -136.93 149.62 47.71 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 105.341 -2.096 . . . . 25.0 105.341 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 163.95 31.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.668 -1.234 . . . . 25.0 107.668 -178.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -102.01 118.78 37.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.439 0.162 . . . . 25.0 111.125 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.4 mt -76.25 132.23 73.69 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -63.34 147.53 93.54 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-O 121.692 0.622 . . . . 25.0 113.576 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.03 -26.15 43.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.25 -0.886 . . . . 25.0 112.769 -169.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -82.09 7.24 13.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.602 0.715 . . . . 25.0 110.113 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -114.44 52.29 0.84 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 107.812 -1.181 . . . . 25.0 107.812 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.92 11.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.041 -1.836 . . . . 25.0 106.041 173.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.68 -168.65 41.94 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 116.116 1.206 . . . . 25.0 116.116 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.15 109.14 18.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.45 0.643 . . . . 25.0 110.881 -169.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.461 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.8 p-80 -158.24 171.32 20.41 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.91 -0.586 . . . . 25.0 111.406 -176.119 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.7 p -102.92 150.2 6.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 107.315 -1.365 . . . . 25.0 107.315 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.1 mt -133.21 127.81 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 102.201 -3.259 . . . . 25.0 102.201 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.0 mp -119.96 141.27 49.81 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.848 -0.614 . . . . 25.0 109.657 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.59 140.43 52.12 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.987 -0.745 . . . . 25.0 108.987 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -127.32 135.84 62.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.059 0.933 . . . . 25.0 112.325 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.7 t90 -95.11 111.43 23.25 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.876 -2.268 . . . . 25.0 104.876 170.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -98.16 119.33 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 -177.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.6 mm -86.44 141.35 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -170.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -83.52 -46.53 12.34 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.348 0.594 . . . . 25.0 110.848 175.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.16 -27.05 66.09 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.788 1.403 . . . . 25.0 114.788 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.2 p -138.06 164.29 29.47 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.172 -0.677 . . . . 25.0 109.172 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -77.85 26.79 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.621 0.971 . . . . 25.0 113.621 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -96.05 148.96 22.12 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.574 -0.704 . . . . 25.0 112.59 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.41 138.24 9.73 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 106.373 -1.714 . . . . 25.0 106.373 170.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -146.86 131.45 17.79 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.242 0.474 . . . . 25.0 112.204 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -91.18 118.01 30.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.156 -0.475 . . . . 25.0 111.449 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -96.99 113.92 25.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.423 -0.954 . . . . 25.0 108.423 178.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.47 142.95 27.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.746 -0.661 . . . . 25.0 112.713 -175.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.47 136.77 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.032 -2.21 . . . . 25.0 105.032 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -97.17 131.58 43.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.68 162.83 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 113.049 0.759 . . . . 25.0 113.049 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -120.06 95.07 4.6 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 167.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.424 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.86 161.09 15.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.158 0.799 . . . . 25.0 113.158 -171.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 66.0 p -145.85 166.45 25.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.83 -0.804 . . . . 25.0 108.83 175.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.755 0 CA-C-O 118.827 -0.606 . . . . 25.0 110.408 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.6 m80 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.471 0.653 . . . . 25.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.5 170.87 38.9 Favored Glycine 0 CA--C 1.509 -0.307 1 N-CA-C 101.282 -4.727 . . . . 25.0 101.282 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -141.72 154.92 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 120.144 1.972 . . . . 25.0 109.787 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.31 119.61 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 106.019 -1.845 . . . . 25.0 106.019 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.32 -44.61 36.05 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.314 -1.312 . . . . 25.0 110.338 -172.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -148.46 124.55 5.27 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -64.65 131.4 12.08 Favored 'Cis proline' 0 CA--C 1.536 0.617 0 C-N-CA 128.7 0.708 . . . . 25.0 111.766 -0.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.84 112.51 4.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -173.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 t -71.98 158.42 36.03 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.576 -0.528 . . . . 25.0 109.576 -178.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -55.33 -25.43 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.714 0.806 . . . . 25.0 112.08 178.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.33 -51.47 52.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.64 0.733 . . . . 25.0 109.296 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.13 -37.03 84.7 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.719 -0.673 . . . . 25.0 109.977 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.7 -32.46 73.56 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 122.344 -0.223 . . . . 25.0 110.97 178.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -40.82 96.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.559 . . . . 25.0 110.323 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.438 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.6 tmtm? -68.15 -34.44 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.27 0.557 . . . . 25.0 109.812 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.7 mt -78.0 6.58 7.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.043 -0.526 . . . . 25.0 111.681 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 59.15 23.19 11.43 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.218 1.407 . . . . 25.0 113.342 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.2 mt -90.09 -21.08 22.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.491 -0.929 . . . . 25.0 108.491 174.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.54 159.97 28.01 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 106.097 -1.816 . . . . 25.0 106.097 178.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 p -135.69 174.59 10.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.566 0.347 . . . . 25.0 111.126 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 66.93 4.99 3.78 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 116.855 2.169 . . . . 25.0 116.855 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -64.89 -38.99 92.83 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 121.664 -0.648 . . . . 25.0 111.261 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.57 1.58 Allowed Glycine 0 C--O 1.217 -0.948 0 O-C-N 123.733 0.646 . . . . 25.0 111.92 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 t -88.07 -52.27 5.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.574 1.178 . . . . 25.0 110.994 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -7.13 7.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.33 -1.305 . . . . 25.0 113.53 -171.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -90.74 -0.74 57.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.851 -0.531 . . . . 25.0 111.302 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -116.39 -34.02 4.75 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.259 -0.577 . . . . 25.0 109.748 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.94 102.44 24.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.461 -0.57 . . . . 25.0 109.461 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.438 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 92.6 Cg_endo -74.37 -20.54 18.34 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 117.383 -1.278 . . . . 25.0 113.955 -174.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -87.03 14.96 6.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.432 0.53 . . . . 25.0 112.432 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 61.5 m -65.09 -21.33 66.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.989 0.424 . . . . 25.0 111.651 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.67 125.96 22.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 115.274 1.583 . . . . 25.0 115.274 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -152.93 159.77 42.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.127 -1.805 . . . . 25.0 106.127 172.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.01 -167.47 21.51 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 107.661 -2.176 . . . . 25.0 107.661 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -119.33 150.67 39.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 118.31 1.055 . . . . 25.0 111.916 -177.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -65.29 152.85 42.74 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.089 -1.448 . . . . 25.0 107.089 172.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.14 2.07 1.65 Allowed Glycine 0 C--N 1.317 -0.498 0 CA-C-N 115.091 -0.958 . . . . 25.0 114.153 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -75.97 140.64 70.5 Favored Pre-proline 0 C--N 1.322 -0.619 0 O-C-N 121.605 -0.938 . . . . 25.0 109.369 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -93.23 -13.45 20.46 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 C-N-CA 130.473 1.447 . . . . 25.0 115.607 -6.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.84 -37.42 76.17 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.489 1.292 . . . . 25.0 114.489 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.48 30.5 7.26 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.57 -179.93 44.83 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 114.384 -1.28 . . . . 25.0 110.79 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -62.54 173.35 3.6 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.985 2.457 . . . . 25.0 113.356 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 160.04 31.05 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 107.207 -1.405 . . . . 25.0 107.207 173.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -60.66 139.69 57.75 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 107.204 -1.406 . . . . 25.0 107.204 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.51 -5.89 79.35 Favored Glycine 0 CA--C 1.511 -0.184 0 CA-C-N 116.232 -0.44 . . . . 25.0 112.628 -174.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -124.97 8.86 8.08 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.517 -0.402 . . . . 25.0 109.954 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.32 -49.48 80.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 122.047 -0.408 . . . . 25.0 111.502 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.33 -16.96 59.64 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.992 -0.442 . . . . 25.0 110.102 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.7 p -87.28 -7.56 57.71 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.02 30.89 10.14 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.521 0.729 . . . . 25.0 110.464 -172.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.97 37.25 24.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.357 1.243 . . . . 25.0 114.357 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.2 135.71 54.89 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.938 0.495 . . . . 25.0 110.807 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 p -61.44 -34.78 76.0 Favored 'General case' 0 C--O 1.213 -0.827 0 N-CA-C 114.627 1.343 . . . . 25.0 114.627 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -69.2 -8.56 46.86 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -178.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -122.68 12.48 9.92 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 108.123 -1.065 . . . . 25.0 108.123 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -70.71 -39.58 73.36 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.901 -1.125 . . . . 25.0 111.176 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -73.38 -11.06 60.35 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.697 0.761 . . . . 25.0 109.423 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.1 mp -88.14 -3.09 58.93 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.768 -0.826 . . . . 25.0 108.768 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -114.11 -34.02 5.5 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.973 0.416 . . . . 25.0 111.357 172.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -86.6 116.1 24.5 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 121.78 -0.575 . . . . 25.0 110.375 -178.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.462 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.8 pm0 -125.46 160.9 28.31 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.401 0.619 . . . . 25.0 110.658 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.1 p -119.88 160.22 43.56 Favored Pre-proline 0 C--N 1.317 -0.816 1 N-CA-C 99.719 -4.178 . . . . 25.0 99.719 160.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.17 -2.63 10.79 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 N-CA-C 116.094 1.536 . . . . 25.0 116.094 -173.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -121.21 9.76 10.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.182 0.515 . . . . 25.0 111.361 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -79.65 -28.66 40.84 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.243 0.831 . . . . 25.0 113.243 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.2 m95 -126.6 168.35 14.43 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.773 0.321 . . . . 25.0 111.259 -176.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -69.6 119.38 13.75 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 106.75 -1.574 . . . . 25.0 106.75 171.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.3 mmtt -93.29 103.08 15.35 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 101.183 -3.636 . . . . 25.0 101.183 177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.79 135.58 55.07 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.917 -1.038 . . . . 25.0 110.621 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -89.69 102.41 15.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.177 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.6 173.85 10.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.577 -1.268 . . . . 25.0 107.577 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.16 157.36 24.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.937 -0.574 . . . . 25.0 111.243 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 139' ' ' ALA . 76.4 p -76.96 168.83 19.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 106.877 -1.527 . . . . 25.0 106.877 171.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.93 -160.93 26.56 Favored Glycine 0 C--O 1.239 0.468 0 N-CA-C 110.424 -1.071 . . . . 25.0 110.424 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.95 131.51 42.16 Favored 'Trans proline' 0 C--N 1.347 0.449 0 CA-C-N 119.061 1.43 . . . . 25.0 114.177 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -137.91 161.94 35.34 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 106.7 -1.592 . . . . 25.0 106.7 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.8 p -103.39 149.49 24.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.392 -1.336 . . . . 25.0 107.392 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -137.57 101.06 4.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.042 -2.207 . . . . 25.0 105.042 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.8 113.99 27.87 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.224 1.011 . . . . 25.0 110.046 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -95.48 146.94 24.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.028 -0.987 . . . . 25.0 108.697 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -124.97 114.45 19.15 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 103.655 -2.72 . . . . 25.0 103.655 179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.12 138.51 48.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.477 -0.783 . . . . 25.0 110.037 -173.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.0 t -101.0 14.53 31.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.241 1.02 . . . . 25.0 109.136 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.5 134.85 29.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.899 -0.591 . . . . 25.0 110.079 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -90.1 5.65 45.87 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.588 0.588 . . . . 25.0 112.588 -179.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.79 153.25 42.38 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.904 -0.406 . . . . 25.0 109.904 178.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 t -74.36 156.07 37.47 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.264 1.209 . . . . 25.0 114.264 -170.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -102.93 157.42 16.99 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -118.01 -14.93 9.97 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 111.541 0.2 . . . . 25.0 111.541 173.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.5 t -172.45 154.26 3.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.975 0.417 . . . . 25.0 111.897 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -126.63 139.05 53.47 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 104.3 -2.481 . . . . 25.0 104.3 167.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 16.8 mtt-85 -144.9 150.61 37.34 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.446 -0.946 . . . . 25.0 108.446 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -137.69 136.22 37.2 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.333 -1.728 . . . . 25.0 106.333 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -148.52 162.43 39.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.515 0.598 . . . . 25.0 110.022 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.99 166.0 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 113.478 0.918 . . . . 25.0 113.478 -167.197 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 13.2 p -80.98 162.39 23.86 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.688 -1.227 . . . . 25.0 107.688 169.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -62.39 158.39 48.58 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.31 -0.859 . . . . 25.0 108.994 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.03 -23.33 34.25 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 116.565 -1.823 . . . . 25.0 114.272 -173.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -113.87 32.06 6.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.576 0.351 . . . . 25.0 111.499 -175.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.4 p-90 -76.14 164.31 26.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.98 0.895 . . . . 25.0 112.541 -176.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -83.04 100.93 10.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.523 -1.217 . . . . 25.0 110.101 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.09 12.88 10.43 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.662 2.097 . . . . 25.0 116.662 -170.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.7 t -121.08 7.91 10.35 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.561 -0.903 . . . . 25.0 108.561 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.22 159.52 32.51 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 107.388 -1.338 . . . . 25.0 107.388 -174.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 158.04 57.04 Favored 'Trans proline' 0 C--N 1.346 0.435 0 O-C-N 121.894 0.418 . . . . 25.0 113.08 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.59 106.32 3.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.898 0.38 . . . . 25.0 110.522 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -103.42 153.66 20.26 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.808 -0.812 . . . . 25.0 108.808 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -64.69 -25.14 67.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.0 0.429 . . . . 25.0 111.484 177.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.12 64.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.623 -0.717 . . . . 25.0 112.221 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.1 t -80.66 -21.06 41.74 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.632 0.73 . . . . 25.0 110.983 -178.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 26.1 m-85 -86.56 152.1 22.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 115.2 1.555 . . . . 25.0 115.2 -176.267 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -95.67 92.82 6.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 102.692 -3.077 . . . . 25.0 102.692 163.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.42 -6.25 13.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -170.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -84.93 131.68 48.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.66 140.91 27.07 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 115.779 -2.347 . . . . 25.0 112.369 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -92.16 -11.87 34.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.382 0.512 . . . . 25.0 112.382 -177.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.4 m -148.98 66.75 1.04 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.503 0.321 . . . . 25.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -88.99 133.52 34.3 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 118.357 -1.337 . . . . 25.0 109.027 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -118.89 99.08 6.52 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 102.715 -3.069 . . . . 25.0 102.715 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -91.53 91.95 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.446 -1.687 . . . . 25.0 106.446 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -110.45 117.28 33.15 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.808 -1.182 . . . . 25.0 107.808 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.01 78.67 0.87 Allowed Glycine 0 CA--C 1.502 -0.772 0 CA-C-N 115.072 -0.967 . . . . 25.0 113.787 -169.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.59 22.21 6.82 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 121.015 -0.612 . . . . 25.0 113.906 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.67 106.71 4.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.802 0.811 . . . . 25.0 109.284 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.32 122.87 88.3 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.975 -1.121 . . . . 25.0 107.975 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -77.92 168.36 22.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 N-CA-C 114.633 0.974 . . . . 25.0 114.633 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -109.21 33.26 4.38 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.83 -18.36 0.31 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.823 1.649 . . . . 25.0 112.76 -177.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -128.58 152.8 47.91 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 104.823 -2.288 . . . . 25.0 104.823 168.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -140.49 95.02 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.0 m -94.85 122.75 37.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.109 -1.441 . . . . 25.0 107.109 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.69 167.05 19.44 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 105.73 -1.952 . . . . 25.0 105.73 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -130.31 151.0 51.29 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.256 -2.128 . . . . 25.0 105.256 175.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 160.5 38.4 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.219 -1.401 . . . . 25.0 107.219 -177.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -103.28 115.8 31.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.091 0.245 . . . . 25.0 111.072 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.29 132.45 73.14 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 107.508 -1.293 . . . . 25.0 107.508 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.47 146.74 96.79 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-O 121.699 0.625 . . . . 25.0 113.519 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.96 -24.91 37.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.219 -0.9 . . . . 25.0 112.658 -168.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -85.46 10.42 12.97 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.622 0.725 . . . . 25.0 110.103 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -116.53 53.53 0.88 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 171.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -85.99 170.97 11.8 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 84.95 -168.3 42.98 Favored Glycine 0 C--N 1.321 -0.295 0 N-CA-C 116.157 1.223 . . . . 25.0 116.157 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.5 t -85.9 108.87 18.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 25.0 111.097 -168.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.425 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 50.0 p-80 -157.46 171.38 20.48 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.993 -0.548 . . . . 25.0 111.388 -176.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.42 151.04 7.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 107.963 -1.125 . . . . 25.0 107.963 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -133.79 122.45 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -106.54 133.39 51.3 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.71 -0.677 . . . . 25.0 109.921 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.24 135.32 53.33 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 122.939 0.495 . . . . 25.0 110.227 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.96 145.87 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 122.13 0.967 . . . . 25.0 112.901 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -113.63 112.95 24.36 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.929 -1.878 . . . . 25.0 105.929 172.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.3 122.27 35.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.707 -1.22 . . . . 25.0 107.707 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 15.5 mm -79.14 141.72 14.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.153 -0.684 . . . . 25.0 109.153 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.32 -42.34 23.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.75 0.704 . . . . 25.0 109.845 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.88 -23.87 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.75 1.018 . . . . 25.0 113.75 -172.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 49.0 p -138.8 169.65 17.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.867 0.841 . . . . 25.0 110.149 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.92 19.01 0.91 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.308 -0.86 . . . . 25.0 112.356 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.05 146.17 24.53 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.26 0.837 . . . . 25.0 113.26 -175.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.65 143.19 11.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 105.291 -2.114 . . . . 25.0 105.291 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -148.06 128.35 13.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 111.632 0.234 . . . . 25.0 111.632 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -86.82 118.34 26.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.032 0.444 . . . . 25.0 110.679 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -96.99 115.44 27.43 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.258 -1.016 . . . . 25.0 108.258 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.7 142.38 29.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.131 -0.486 . . . . 25.0 111.921 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -127.15 136.22 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 105.1 -2.185 . . . . 25.0 105.1 166.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -97.02 130.63 44.31 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.054 -1.461 . . . . 25.0 107.054 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.17 162.5 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 113.101 0.778 . . . . 25.0 113.101 -174.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.67 94.99 4.66 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 104.382 -2.451 . . . . 25.0 104.382 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.54 163.76 14.48 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.4 p -145.9 164.09 33.08 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.954 -1.128 . . . . 25.0 107.954 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-O 117.74 -1.124 . . . . 25.0 111.536 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 121.086 0.469 . . . . 25.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.67 170.88 22.99 Favored Glycine 0 CA--C 1.509 -0.342 1 N-CA-C 101.652 -4.579 . . . . 25.0 101.652 -175.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -146.62 163.16 36.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 120.297 2.049 . . . . 25.0 110.687 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -97.86 121.87 48.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -41.79 53.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.624 -1.171 . . . . 25.0 109.863 -174.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.64 129.3 5.17 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 106.018 -1.845 . . . . 25.0 106.018 176.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -64.46 132.25 13.62 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 128.751 0.73 . . . . 25.0 111.093 -0.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.78 112.61 4.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.038 -0.528 . . . . 25.0 111.855 -172.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.8 t -71.93 158.34 36.2 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 108.185 -1.043 . . . . 25.0 108.185 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -55.57 -24.77 34.49 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.304 0.642 . . . . 25.0 112.049 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.17 -53.78 33.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.819 0.819 . . . . 25.0 109.43 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -67.65 -35.09 78.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.505 -0.77 . . . . 25.0 110.564 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.68 -33.0 74.66 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.111 -0.368 . . . . 25.0 110.734 178.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -40.79 98.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.347 0.594 . . . . 25.0 109.555 177.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -67.85 -35.03 77.85 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.215 0.531 . . . . 25.0 110.185 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.69 5.47 9.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 25.0 111.436 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 59.1 24.95 13.32 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.097 1.359 . . . . 25.0 112.78 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.1 mt -91.14 -21.84 20.98 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.131 -1.063 . . . . 25.0 108.131 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -124.06 159.9 28.88 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.011 -1.848 . . . . 25.0 106.011 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.2 p -134.73 175.49 9.5 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 122.261 0.225 . . . . 25.0 110.508 -176.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 70.21 5.08 5.15 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.574 1.694 . . . . 25.0 115.574 175.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.9 m -66.66 -38.49 86.95 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 121.412 -0.805 . . . . 25.0 110.565 172.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.63 -63.94 1.48 Allowed Glycine 0 C--O 1.218 -0.861 0 O-C-N 123.754 0.659 . . . . 25.0 112.114 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.3 t -88.06 -52.82 5.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.423 1.106 . . . . 25.0 111.098 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.64 -9.97 12.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.697 -1.138 . . . . 25.0 113.54 -171.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.97 -3.06 58.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.857 -0.527 . . . . 25.0 111.266 177.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -116.25 -34.02 4.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.456 -0.572 . . . . 25.0 109.456 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -126.9 97.67 32.24 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 109.989 -0.375 . . . . 25.0 109.989 173.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -74.97 -20.73 16.65 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 118.041 -0.839 . . . . 25.0 113.956 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -84.14 11.01 8.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.471 0.545 . . . . 25.0 112.471 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.7 m -64.83 -22.57 67.02 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.448 0.536 . . . . 25.0 112.448 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 9.1 m -64.04 121.42 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 115.12 1.526 . . . . 25.0 115.12 -173.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -152.82 158.54 42.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 106.517 -1.66 . . . . 25.0 106.517 174.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.47 -166.18 18.76 Favored Glycine 0 N--CA 1.453 -0.209 0 N-CA-C 108.094 -2.003 . . . . 25.0 108.094 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -120.02 148.67 43.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.382 1.091 . . . . 25.0 112.079 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.39 157.0 33.0 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 171.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.25 2.02 1.64 Allowed Glycine 0 C--O 1.224 -0.493 0 CA-C-N 114.802 -1.09 . . . . 25.0 113.766 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -75.94 139.31 69.47 Favored Pre-proline 0 C--N 1.322 -0.622 0 O-C-N 121.576 -0.955 . . . . 25.0 110.067 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -93.45 -14.8 17.08 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 C-N-CA 130.35 1.396 . . . . 25.0 115.613 -6.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -70.98 -35.82 72.27 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.936 1.458 . . . . 25.0 114.936 -168.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -121.39 31.63 6.24 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 105.553 -2.018 . . . . 25.0 105.553 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.48 -177.61 41.45 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 114.389 -1.278 . . . . 25.0 111.749 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.3 172.5 3.26 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 123.505 2.803 . . . . 25.0 113.498 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 160.01 31.03 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.141 -1.429 . . . . 25.0 107.141 173.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -61.21 139.13 58.19 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.249 -1.389 . . . . 25.0 107.249 175.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.06 86.37 Favored Glycine 0 C--O 1.228 -0.275 0 CA-C-N 116.079 -0.51 . . . . 25.0 112.593 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -125.58 9.58 7.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.906 -0.775 . . . . 25.0 108.906 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.38 -49.51 74.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 122.132 -0.355 . . . . 25.0 111.631 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.1 -25.39 59.77 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.637 -0.505 . . . . 25.0 109.637 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.4 p -79.85 -9.77 59.7 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.181 0.437 . . . . 25.0 112.181 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.37 34.4 14.93 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.857 0.863 . . . . 25.0 109.984 -172.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.23 39.26 25.95 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.951 1.463 . . . . 25.0 114.951 -177.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -120.16 134.63 55.21 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.992 0.517 . . . . 25.0 110.614 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -61.68 -35.76 78.9 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 115.368 1.618 . . . . 25.0 115.368 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.03 -7.18 44.6 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.308 0.575 . . . . 25.0 112.456 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.7 m-85 -121.74 13.47 10.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -72.14 -37.29 69.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.192 -0.942 . . . . 25.0 110.841 -175.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.7 mp0 -69.81 -17.02 63.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.85 0.833 . . . . 25.0 109.802 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.26 -5.47 59.32 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.902 -0.777 . . . . 25.0 108.902 -177.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.55 -32.82 6.34 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.561 0.578 . . . . 25.0 112.561 173.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -97.61 119.49 36.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 O-C-N 121.458 -0.776 . . . . 25.0 110.629 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.475 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -123.92 160.95 26.39 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.383 -0.826 . . . . 25.0 109.596 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -117.29 162.48 27.91 Favored Pre-proline 0 C--N 1.317 -0.824 1 N-CA-C 99.908 -4.108 . . . . 25.0 99.908 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.33 -5.34 15.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 116.559 -1.828 . . . . 25.0 115.763 -174.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.25 10.38 9.29 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.177 0.513 . . . . 25.0 111.77 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -78.8 -28.77 44.62 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.042 0.756 . . . . 25.0 113.042 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.475 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.1 m95 -126.94 165.41 19.46 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 120.787 0.327 . . . . 25.0 110.463 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.58 131.41 45.95 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 105.959 -1.867 . . . . 25.0 105.959 170.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -101.2 106.85 18.11 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 101.06 -3.681 . . . . 25.0 101.06 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.21 136.18 51.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.952 -1.022 . . . . 25.0 110.329 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -90.23 104.04 16.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.802 -1.09 . . . . 25.0 108.478 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.3 mt -129.92 173.91 10.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.542 -1.281 . . . . 25.0 107.542 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.59 157.64 24.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.768 -0.651 . . . . 25.0 111.472 -174.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 69.6 p -77.04 169.52 18.18 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.154 -1.425 . . . . 25.0 107.154 172.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.2 -161.69 27.93 Favored Glycine 0 C--O 1.239 0.413 0 N-CA-C 110.702 -0.959 . . . . 25.0 110.702 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.88 132.2 46.28 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 119.012 1.406 . . . . 25.0 113.964 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -137.26 160.88 37.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.289 -1.745 . . . . 25.0 106.289 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.5 p -104.84 152.03 23.09 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.53 -1.285 . . . . 25.0 107.53 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -139.15 101.06 4.18 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.37 -2.085 . . . . 25.0 105.37 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.1 113.45 26.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.977 0.894 . . . . 25.0 109.924 -178.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -99.59 145.13 27.88 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.184 -0.917 . . . . 25.0 110.055 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -123.19 108.91 13.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.968 -2.234 . . . . 25.0 104.968 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -104.83 135.46 46.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.601 -0.727 . . . . 25.0 109.86 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.7 t -101.28 17.67 21.96 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.723 0.773 . . . . 25.0 109.95 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.29 141.35 33.94 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.992 -0.744 . . . . 25.0 108.992 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -85.29 -4.85 59.3 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.662 0.615 . . . . 25.0 112.662 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.85 155.13 31.51 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.564 0.579 . . . . 25.0 112.564 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -74.39 155.83 37.68 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -173.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.446 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 9.8 t -99.09 157.94 16.0 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.013 -1.106 . . . . 25.0 108.013 173.694 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -117.75 -16.62 10.0 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.738 0.273 . . . . 25.0 111.738 172.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 t -171.91 152.44 2.99 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.869 0.366 . . . . 25.0 111.886 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -124.95 139.63 53.65 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.389 -2.449 . . . . 25.0 104.389 167.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -144.56 148.67 34.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.128 -1.064 . . . . 25.0 108.128 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.95 134.69 35.24 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.64 161.37 42.31 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.364 0.529 . . . . 25.0 110.187 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 163.15 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.52 0.933 . . . . 25.0 113.52 -167.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 p -77.46 161.15 28.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.811 -1.181 . . . . 25.0 107.811 171.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -61.44 157.24 47.28 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.044 -0.98 . . . . 25.0 109.16 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.89 -23.6 34.75 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.95 -1.566 . . . . 25.0 114.13 -172.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -113.36 32.01 6.07 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 122.621 0.368 . . . . 25.0 111.544 -174.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -78.7 163.68 25.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.838 0.827 . . . . 25.0 111.587 -177.07 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -87.86 100.98 13.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.844 -1.071 . . . . 25.0 110.393 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -78.85 21.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 116.158 1.91 . . . . 25.0 116.158 -173.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -120.74 -0.78 10.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.37 0.605 . . . . 25.0 109.826 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -101.64 156.49 35.13 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.376 -0.829 . . . . 25.0 108.806 -176.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.39 158.27 57.84 Favored 'Trans proline' 0 C--N 1.346 0.437 0 O-C-N 121.882 0.411 . . . . 25.0 111.525 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.99 97.61 1.91 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.324 0.583 . . . . 25.0 112.105 -176.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.7 p -91.87 152.94 19.85 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.474 -0.935 . . . . 25.0 108.474 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -65.26 -25.48 67.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.246 0.546 . . . . 25.0 111.049 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.87 -27.1 66.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.419 -0.81 . . . . 25.0 112.295 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 t -84.65 -5.87 59.33 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.054 0.391 . . . . 25.0 112.054 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -100.7 154.21 18.8 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 114.105 1.15 . . . . 25.0 114.105 -175.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -94.59 93.92 7.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 102.633 -3.099 . . . . 25.0 102.633 163.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.34 -7.3 23.6 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -169.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.8 t -83.68 128.31 64.18 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 176.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.71 146.51 48.79 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 115.278 -2.682 . . . . 25.0 111.336 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -97.11 -10.23 26.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.979 0.419 . . . . 25.0 111.527 -177.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.3 m -148.97 67.25 1.04 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.57 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -88.98 132.33 34.77 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 118.967 -1.093 . . . . 25.0 108.79 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -124.41 98.98 5.98 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 104.738 -2.319 . . . . 25.0 104.738 177.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -92.55 92.16 7.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -103.74 117.61 34.78 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 107.278 -1.379 . . . . 25.0 107.278 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -97.71 78.35 0.63 Allowed Glycine 0 CA--C 1.504 -0.636 0 CA-C-N 115.447 -0.797 . . . . 25.0 114.021 -169.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 112.3 22.0 6.01 Favored Glycine 0 C--N 1.321 -0.28 0 C-N-CA 120.817 -0.706 . . . . 25.0 113.203 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.68 107.03 5.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.531 0.681 . . . . 25.0 109.363 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.06 123.0 88.61 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 106.036 -1.838 . . . . 25.0 106.036 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.91 171.6 17.69 Favored 'Trans proline' 0 C--N 1.345 0.343 0 N-CA-C 113.715 0.621 . . . . 25.0 113.715 -175.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.11 27.27 5.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.581 -0.896 . . . . 25.0 108.581 176.233 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.56 -17.77 0.27 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.716 1.607 . . . . 25.0 112.365 -174.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 128' ' ' ALA . 67.5 mt-30 -127.23 153.33 46.24 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 103.494 -2.78 . . . . 25.0 103.494 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 69.5 t -141.41 95.08 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.604 0 N-CA-C 106.263 -1.754 . . . . 25.0 106.263 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.5 t -85.96 143.79 27.98 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 103.557 -2.757 . . . . 25.0 103.557 172.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.04 167.0 29.86 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.933 -1.485 . . . . 25.0 107.59 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -134.67 156.05 49.44 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.654 -1.61 . . . . 25.0 106.654 174.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.6 160.34 25.71 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.098 -1.445 . . . . 25.0 107.098 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -104.75 116.96 32.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.054 0.222 . . . . 25.0 110.979 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.86 132.12 68.66 Favored Pre-proline 0 CA--C 1.54 0.576 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -61.96 147.94 94.14 Favored 'Trans proline' 0 C--N 1.352 0.716 0 CA-C-O 121.652 0.605 . . . . 25.0 113.474 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.57 -26.54 34.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.32 -0.855 . . . . 25.0 112.594 -169.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -83.6 10.1 9.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.602 0.715 . . . . 25.0 110.305 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.3 mmt-85 -116.34 50.0 1.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.568 -0.901 . . . . 25.0 108.568 172.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 35.9 p -86.0 164.94 17.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.672 -1.603 . . . . 25.0 106.672 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.97 -167.94 31.0 Favored Glycine 0 N--CA 1.451 -0.339 0 N-CA-C 115.043 0.777 . . . . 25.0 115.043 177.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -85.99 111.03 19.89 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.369 0.604 . . . . 25.0 110.908 -168.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.427 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 48.5 p-80 -159.14 171.08 20.59 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 115.913 -0.585 . . . . 25.0 111.241 -176.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.0 p -104.75 150.5 7.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.6 mt -132.24 120.99 45.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.83 131.53 52.19 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.394 -0.821 . . . . 25.0 109.62 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -123.59 133.14 54.0 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.519 -0.549 . . . . 25.0 109.519 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.46 143.78 36.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 122.073 0.939 . . . . 25.0 112.356 -178.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.446 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.8 t90 -113.8 113.22 24.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.872 -1.899 . . . . 25.0 105.872 173.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.64 125.74 38.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.981 -1.118 . . . . 25.0 107.981 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.6 mm -80.71 142.1 14.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.901 -0.777 . . . . 25.0 108.901 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.53 -43.49 22.99 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 118.806 0.73 . . . . 25.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.2 -23.24 64.81 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.749 1.018 . . . . 25.0 113.749 -172.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.1 p -138.63 168.76 19.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.962 0.887 . . . . 25.0 110.022 -175.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.88 21.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.216 -0.902 . . . . 25.0 112.313 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -91.63 145.27 24.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.076 0.769 . . . . 25.0 113.076 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.55 143.58 13.29 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 105.106 -2.183 . . . . 25.0 105.106 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -148.55 129.77 14.62 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.137 0.421 . . . . 25.0 112.137 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -85.53 117.37 24.39 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 121.105 0.479 . . . . 25.0 111.063 177.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -97.12 108.19 20.87 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.318 -1.364 . . . . 25.0 107.318 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.16 142.76 30.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.829 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -126.9 136.1 61.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 105.424 -2.065 . . . . 25.0 105.424 168.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -97.02 129.11 44.52 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.51 163.07 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.157 0.799 . . . . 25.0 113.157 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -117.83 95.28 4.85 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 103.994 -2.595 . . . . 25.0 103.994 166.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.6 tp -89.94 163.04 15.12 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 120.909 0.385 . . . . 25.0 111.652 -172.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.0 p -145.85 158.03 43.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 118.113 -0.946 . . . . 25.0 111.368 -178.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.0 m170 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 110.599 -0.149 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.23 166.09 11.89 Favored Glycine 0 N--CA 1.459 0.217 1 N-CA-C 102.758 -4.137 . . . . 25.0 102.758 -174.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.2 p90 -149.38 168.12 24.27 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.444 2.122 . . . . 25.0 111.921 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -103.82 124.37 58.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.565 -1.272 . . . . 25.0 107.565 176.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.89 -43.18 30.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.922 -1.036 . . . . 25.0 109.968 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -152.89 129.8 5.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.923 -1.88 . . . . 25.0 105.923 176.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.76 130.79 9.84 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.933 0.806 . . . . 25.0 111.451 0.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.76 4.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.875 -0.602 . . . . 25.0 112.11 -172.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.7 t -72.14 157.34 37.93 Favored 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 108.667 -0.864 . . . . 25.0 108.667 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -55.2 -25.61 33.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.726 0.81 . . . . 25.0 111.924 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.26 30.21 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.824 0.821 . . . . 25.0 109.157 175.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -66.48 -35.74 81.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.498 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.3 -33.36 75.35 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 122.157 -0.34 . . . . 25.0 110.849 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -39.79 94.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.225 0.536 . . . . 25.0 109.862 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -68.21 -35.19 77.59 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.226 0.536 . . . . 25.0 110.034 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -77.77 4.4 11.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 25.0 111.278 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 58.95 22.39 10.29 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.175 1.39 . . . . 25.0 112.975 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.55 -21.69 26.76 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 174.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -123.75 158.81 30.84 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 105.435 -2.061 . . . . 25.0 105.435 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.3 p -135.81 176.95 8.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.439 -0.578 . . . . 25.0 109.439 -176.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 71.3 5.13 5.33 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.442 1.645 . . . . 25.0 115.442 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -68.76 -38.13 79.87 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 121.53 -0.732 . . . . 25.0 110.821 174.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.8 -63.62 1.55 Allowed Glycine 0 C--O 1.217 -0.924 0 O-C-N 123.713 0.633 . . . . 25.0 112.116 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.8 t -88.0 -53.31 4.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 122.503 1.144 . . . . 25.0 111.643 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.9 OUTLIER -68.28 -11.11 13.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.563 -1.199 . . . . 25.0 113.239 -171.881 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -86.91 -2.71 58.81 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.751 -0.593 . . . . 25.0 111.479 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -116.25 -34.11 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.129 -0.628 . . . . 25.0 109.594 173.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -126.9 92.44 44.55 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 120.926 0.393 . . . . 25.0 111.463 171.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.401 ' HA ' HG12 ' A' ' 25' ' ' VAL . 85.6 Cg_endo -74.15 -19.13 20.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 117.66 -1.093 . . . . 25.0 114.022 -176.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.99 5.38 41.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.231 0.456 . . . . 25.0 112.231 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -2.28 24.33 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.993 0.738 . . . . 25.0 112.993 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.3 m -64.08 138.03 23.76 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 N-CA-C 113.343 0.868 . . . . 25.0 113.343 -177.011 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -153.02 152.28 31.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.345 -0.843 . . . . 25.0 108.779 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.58 -176.35 33.58 Favored Glycine 0 N--CA 1.452 -0.256 0 N-CA-C 107.346 -2.302 . . . . 25.0 107.346 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.84 150.3 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 118.364 1.082 . . . . 25.0 111.758 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.52 156.98 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.602 -1.258 . . . . 25.0 107.602 172.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.82 -1.74 3.57 Favored Glycine 0 C--O 1.224 -0.504 0 CA-C-N 114.756 -1.111 . . . . 25.0 112.797 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -75.98 142.1 72.22 Favored Pre-proline 0 C--N 1.322 -0.617 0 O-C-N 121.546 -0.973 . . . . 25.0 109.374 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -91.89 -13.74 23.15 Favored 'Cis proline' 0 CA--C 1.541 0.87 0 C-N-CA 130.065 1.277 . . . . 25.0 115.227 -6.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -70.71 -37.81 73.57 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.782 1.401 . . . . 25.0 114.782 -169.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.79 34.95 5.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.118 -1.808 . . . . 25.0 106.118 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.45 -174.41 46.06 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 114.613 -1.176 . . . . 25.0 111.311 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -59.8 173.71 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 124.257 3.305 . . . . 25.0 113.049 176.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.95 159.92 31.22 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.915 -1.513 . . . . 25.0 106.915 173.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -61.03 139.36 58.08 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.24 -5.05 81.98 Favored Glycine 0 C--O 1.228 -0.224 0 CA-C-N 116.06 -0.518 . . . . 25.0 112.826 -174.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -124.2 10.88 8.74 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.26 -0.644 . . . . 25.0 109.26 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.63 -49.96 74.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 122.272 -0.267 . . . . 25.0 111.291 -174.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.39 -24.66 59.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.709 -0.478 . . . . 25.0 109.709 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 p -80.45 -9.74 59.75 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.269 0.47 . . . . 25.0 112.269 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.28 34.43 14.73 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.689 0.795 . . . . 25.0 110.267 -172.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.55 41.16 26.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.467 1.284 . . . . 25.0 114.467 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -121.31 136.26 54.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.345 0.658 . . . . 25.0 110.529 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -63.5 -35.26 79.89 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -175.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.03 -7.12 47.01 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.621 0.6 . . . . 25.0 112.621 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.689 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.4 m-85 -120.13 13.58 12.1 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 107.14 -1.43 . . . . 25.0 107.14 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.54 -35.71 68.1 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.998 -1.064 . . . . 25.0 110.604 -175.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 -69.26 -17.37 63.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.923 0.868 . . . . 25.0 109.646 174.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.689 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.44 -5.36 59.18 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.485 -0.78 . . . . 25.0 109.007 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -113.97 -32.6 6.01 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.284 0.476 . . . . 25.0 112.284 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -91.65 115.89 28.42 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 121.583 -0.698 . . . . 25.0 110.34 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.457 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -125.17 161.02 27.79 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.149 -0.686 . . . . 25.0 109.149 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -116.55 163.96 20.2 Favored Pre-proline 0 C--N 1.317 -0.827 0 N-CA-C 100.348 -3.945 . . . . 25.0 100.348 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.88 -4.04 12.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 116.74 -1.707 . . . . 25.0 115.86 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -127.98 12.52 6.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.355 0.598 . . . . 25.0 111.506 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -76.6 -28.8 56.28 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.283 0.846 . . . . 25.0 113.283 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.4 m95 -126.14 167.12 15.83 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 120.598 0.237 . . . . 25.0 110.557 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -66.68 119.86 12.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.815 -1.921 . . . . 25.0 105.815 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -94.0 103.5 15.58 Favored 'General case' 0 CA--C 1.5 -0.975 1 N-CA-C 100.094 -4.039 . . . . 25.0 100.094 177.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.31 135.05 54.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.926 -1.034 . . . . 25.0 110.312 -176.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -90.4 101.09 13.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.648 -1.16 . . . . 25.0 108.296 -177.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -129.38 173.89 10.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.673 -1.232 . . . . 25.0 107.673 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.25 155.36 25.21 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 25.0 111.709 -174.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.414 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.9 p -76.99 167.99 20.87 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 172.047 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.1 -160.89 25.18 Favored Glycine 0 C--O 1.24 0.487 0 N-CA-C 110.609 -0.997 . . . . 25.0 110.609 -178.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.99 133.62 54.67 Favored 'Trans proline' 0 C--N 1.346 0.446 0 CA-C-N 119.019 1.41 . . . . 25.0 113.931 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -138.79 160.74 38.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.797 -1.557 . . . . 25.0 106.797 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -103.1 151.12 22.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.329 -1.359 . . . . 25.0 107.329 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -138.57 101.04 4.25 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 105.455 -2.054 . . . . 25.0 105.455 -177.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.61 116.45 32.09 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.949 0.88 . . . . 25.0 109.132 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -104.07 150.37 24.35 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.218 -0.901 . . . . 25.0 109.794 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -127.79 111.67 13.91 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.0 mp -109.22 122.36 47.16 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.633 -0.712 . . . . 25.0 111.71 -173.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.5 17.69 4.39 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.479 0.657 . . . . 25.0 111.227 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.33 140.37 33.77 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 121.615 -0.678 . . . . 25.0 110.133 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -82.55 -8.55 59.6 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.852 -0.613 . . . . 25.0 112.025 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -63.8 156.18 28.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -175.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.6 t -83.36 155.99 23.25 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 114.239 1.2 . . . . 25.0 114.239 -171.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -99.65 157.22 16.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.876 -0.602 . . . . 25.0 109.469 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -117.94 -14.22 10.03 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.559 0.207 . . . . 25.0 111.559 172.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.1 t -172.61 150.31 2.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.807 0.337 . . . . 25.0 111.824 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -122.86 139.5 53.95 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 104.521 -2.4 . . . . 25.0 104.521 166.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -144.75 151.83 39.45 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.454 -1.313 . . . . 25.0 107.454 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.94 134.39 34.89 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.75 -1.945 . . . . 25.0 105.75 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 164.01 34.72 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.345 0.52 . . . . 25.0 109.881 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.92 164.28 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 113.481 0.919 . . . . 25.0 113.481 -167.52 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -78.65 162.36 26.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -62.07 157.77 49.78 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.264 -0.88 . . . . 25.0 109.065 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.33 -25.34 36.31 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 116.534 -1.844 . . . . 25.0 114.036 -173.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -113.0 31.99 6.03 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.694 0.397 . . . . 25.0 110.882 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.67 165.02 25.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.031 0.919 . . . . 25.0 112.982 -175.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -83.1 100.93 10.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.496 -1.229 . . . . 25.0 109.857 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -88.14 12.2 14.28 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 116.693 2.109 . . . . 25.0 116.693 -169.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.4 t -119.23 6.45 11.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 176.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -109.71 156.62 39.44 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.666 -1.152 . . . . 25.0 108.042 -174.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.53 156.85 64.39 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 O-C-N 121.942 0.443 . . . . 25.0 111.847 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.05 105.17 3.24 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.28 0.562 . . . . 25.0 112.075 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.0 p -98.64 154.82 17.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.772 -0.825 . . . . 25.0 108.772 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -65.0 -26.05 68.12 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.913 -0.492 . . . . 25.0 111.484 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.84 -26.95 65.41 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.702 -0.681 . . . . 25.0 112.112 176.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 35.3 t -83.34 -5.39 59.13 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -101.96 153.7 19.63 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -94.86 95.42 8.66 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 102.556 -3.128 . . . . 25.0 102.556 163.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.1 mt -67.06 -6.81 18.79 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -169.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.1 t -86.95 131.28 45.42 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.951 -0.759 . . . . 25.0 108.951 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -72.64 149.63 49.36 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 115.54 -2.506 . . . . 25.0 111.446 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -99.62 -12.07 20.39 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.151 0.426 . . . . 25.0 112.151 -177.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.7 m -147.47 65.86 1.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.366 -0.379 . . . . 25.0 110.357 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -88.99 135.87 33.32 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 118.458 -1.297 . . . . 25.0 109.176 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -123.19 99.13 6.2 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 103.406 -2.813 . . . . 25.0 103.406 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -91.83 92.06 8.2 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 106.535 -1.654 . . . . 25.0 106.535 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -109.91 119.32 38.97 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 107.984 -1.117 . . . . 25.0 107.984 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.64 77.94 0.82 Allowed Glycine 0 CA--C 1.503 -0.713 0 CA-C-N 115.33 -0.85 . . . . 25.0 113.844 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.98 23.56 6.39 Favored Glycine 0 C--N 1.32 -0.306 0 C-N-CA 120.899 -0.667 . . . . 25.0 114.08 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.06 105.89 4.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.792 0.806 . . . . 25.0 110.005 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 87.7 mt -69.97 127.06 92.67 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 106.596 -1.631 . . . . 25.0 106.596 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.17 169.73 21.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 N-CA-C 113.998 0.73 . . . . 25.0 113.998 -176.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.417 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.89 30.86 4.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.784 -1.191 . . . . 25.0 107.784 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.61 -21.02 0.22 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.997 1.719 . . . . 25.0 111.969 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.417 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.7 mt-30 -126.64 156.56 40.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 104.219 -2.512 . . . . 25.0 104.219 169.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -138.96 95.07 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.134 -2.173 . . . . 25.0 105.134 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.7 t -87.84 139.98 29.97 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.936 -2.616 . . . . 25.0 103.936 174.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -152.62 166.93 30.55 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 113.883 -1.508 . . . . 25.0 108.779 -175.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -135.44 155.89 49.8 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.058 -1.83 . . . . 25.0 106.058 174.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.06 161.32 25.27 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.019 -1.474 . . . . 25.0 107.019 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -105.89 118.65 37.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.992 0.182 . . . . 25.0 110.868 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.2 131.9 61.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -61.99 147.2 95.62 Favored 'Trans proline' 0 C--N 1.353 0.784 0 CA-C-O 121.615 0.59 . . . . 25.0 113.456 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.414 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.75 -25.69 35.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 25.0 112.526 -169.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -83.58 9.74 10.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.684 0.754 . . . . 25.0 110.192 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.99 52.97 0.88 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.4 p -86.0 166.92 15.51 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.983 -1.488 . . . . 25.0 106.983 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.74 -166.76 34.43 Favored Glycine 0 C--O 1.238 0.389 0 N-CA-C 115.926 1.131 . . . . 25.0 115.926 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.0 t -86.01 107.6 17.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.436 0.636 . . . . 25.0 110.813 -168.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -157.93 171.27 20.56 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.774 -0.648 . . . . 25.0 110.871 -176.34 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.57 149.98 7.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.64 -1.245 . . . . 25.0 107.64 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.99 127.71 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 101.665 -3.458 . . . . 25.0 101.665 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.92 132.0 56.81 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.711 -0.477 . . . . 25.0 109.711 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -110.92 128.69 55.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.6 p -122.29 137.93 54.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.991 0.9 . . . . 25.0 111.014 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.4 t90 -115.71 116.19 27.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.783 -1.553 . . . . 25.0 107.008 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.3 126.91 40.93 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.959 -1.126 . . . . 25.0 107.959 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 18.8 mm -82.6 140.96 15.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.19 -43.07 29.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.824 0.738 . . . . 25.0 110.014 176.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.36 -23.59 64.7 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 114.092 1.145 . . . . 25.0 114.092 -172.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.4 p -138.78 169.76 17.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.993 0.901 . . . . 25.0 110.118 -174.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.28 19.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.142 -0.935 . . . . 25.0 112.491 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -90.04 146.99 23.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.852 0.686 . . . . 25.0 112.852 -176.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.03 141.74 15.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 104.576 -2.379 . . . . 25.0 104.576 170.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -146.39 134.79 21.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.262 0.467 . . . . 25.0 112.262 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -91.56 115.1 27.77 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.918 0.762 . . . . 25.0 110.808 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -97.05 108.1 20.76 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.446 -1.316 . . . . 25.0 107.446 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.38 139.99 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.377 -0.829 . . . . 25.0 111.757 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 132.86 70.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 105.311 -2.107 . . . . 25.0 105.311 167.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -94.02 130.41 40.16 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.981 -1.489 . . . . 25.0 106.981 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.4 m -131.81 161.35 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.912 0.708 . . . . 25.0 112.912 -175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -117.71 95.0 4.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 103.654 -2.721 . . . . 25.0 103.654 166.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.4 HD23 HG22 ' A' ' 74' ' ' THR . 2.8 tp -89.93 161.27 16.0 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.086 0.47 . . . . 25.0 111.825 -171.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.2 p -145.86 164.29 32.41 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.815 -0.809 . . . . 25.0 108.815 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.707 0 CA-C-O 118.041 -0.98 . . . . 25.0 110.378 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.9 m80 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.246 0.546 . . . . 25.0 110.372 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.41 177.53 35.51 Favored Glycine 0 CA--C 1.508 -0.348 1 N-CA-C 101.717 -4.553 . . . . 25.0 101.717 -176.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -148.16 165.82 29.74 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.019 1.91 . . . . 25.0 109.414 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -100.59 122.43 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 106.481 -1.674 . . . . 25.0 106.481 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.24 -43.21 52.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.708 -1.133 . . . . 25.0 109.859 -173.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.69 129.76 5.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.194 -1.78 . . . . 25.0 106.194 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.43 130.83 10.69 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.89 0.788 . . . . 25.0 111.386 -0.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.21 113.4 5.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.985 -0.552 . . . . 25.0 112.334 -172.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -72.1 158.23 36.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.038 -0.727 . . . . 25.0 109.038 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -55.32 -25.23 33.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.387 0.675 . . . . 25.0 112.02 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.35 36.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.782 0.801 . . . . 25.0 109.455 176.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -67.61 -35.7 79.44 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.456 -0.793 . . . . 25.0 110.301 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -63.6 -33.18 75.04 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 120.97 -0.292 . . . . 25.0 110.759 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -40.31 96.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.257 0.551 . . . . 25.0 110.092 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.3 tmtm? -68.14 -35.4 78.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.28 0.562 . . . . 25.0 110.071 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.88 4.43 9.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.098 -0.501 . . . . 25.0 111.518 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 58.75 23.69 11.43 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.22 1.408 . . . . 25.0 112.851 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.8 mt -87.89 -22.43 24.4 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.611 -1.255 . . . . 25.0 107.611 174.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -123.62 159.34 29.48 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 105.316 -2.105 . . . . 25.0 105.316 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -135.36 175.23 9.78 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.352 -0.24 . . . . 25.0 110.352 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 70.32 5.4 5.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.783 1.771 . . . . 25.0 115.783 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.47 -34.44 77.94 Favored 'General case' 0 CA--C 1.497 -1.059 0 O-C-N 121.375 -0.828 . . . . 25.0 110.359 172.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.36 -64.14 1.38 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.9 0.75 . . . . 25.0 112.153 179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.9 t -87.98 -53.41 4.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 122.539 1.162 . . . . 25.0 111.633 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.18 -10.73 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 114.523 -1.217 . . . . 25.0 113.233 -171.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -85.5 -3.53 58.89 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.917 -0.489 . . . . 25.0 111.13 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -115.66 -34.09 4.97 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.407 -0.517 . . . . 25.0 110.005 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -126.94 98.81 29.94 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 120.672 0.273 . . . . 25.0 110.798 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.0 Cg_endo -76.92 -20.77 12.92 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 117.619 -1.121 . . . . 25.0 114.312 -174.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -82.27 9.06 9.56 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.211 0.449 . . . . 25.0 112.211 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -64.94 -23.2 67.15 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.15 0.796 . . . . 25.0 113.15 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.06 122.95 15.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 115.226 1.565 . . . . 25.0 115.226 -172.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.93 159.1 42.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 105.778 -1.934 . . . . 25.0 105.778 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.15 -168.58 23.23 Favored Glycine 0 N--CA 1.454 -0.156 0 N-CA-C 108.879 -1.689 . . . . 25.0 108.879 -177.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.4 tp -115.11 147.36 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.241 1.021 . . . . 25.0 112.062 -177.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -65.56 157.03 30.84 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.033 -0.729 . . . . 25.0 109.033 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.57 0.14 2.38 Favored Glycine 0 C--O 1.222 -0.646 0 CA-C-N 114.504 -1.225 . . . . 25.0 113.732 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -75.87 138.36 69.57 Favored Pre-proline 0 C--N 1.322 -0.628 0 O-C-N 121.402 -1.057 . . . . 25.0 110.815 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -92.77 -14.73 18.69 Favored 'Cis proline' 0 CA--C 1.544 0.98 0 C-N-CA 130.259 1.358 . . . . 25.0 115.385 -7.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -69.38 -35.62 76.0 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.162 1.541 . . . . 25.0 115.162 -168.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.97 34.1 4.94 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 105.846 -1.909 . . . . 25.0 105.846 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.78 -170.75 40.36 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.489 -1.232 . . . . 25.0 111.748 -176.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -60.5 170.39 4.34 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.994 2.462 . . . . 25.0 113.104 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 159.84 31.2 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.729 -1.582 . . . . 25.0 106.729 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -61.75 140.26 58.23 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.43 85.6 Favored Glycine 0 N--CA 1.453 -0.206 0 CA-C-N 115.782 -0.645 . . . . 25.0 112.373 -174.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -125.85 12.75 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.954 -0.387 . . . . 25.0 109.954 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.45 -52.87 46.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.122 -0.361 . . . . 25.0 111.824 -173.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.15 -20.04 59.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.889 -0.507 . . . . 25.0 109.969 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 p -83.24 -9.43 59.14 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.889 -0.325 . . . . 25.0 111.826 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.07 34.21 13.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.822 0.849 . . . . 25.0 110.342 -172.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.07 37.33 24.29 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.666 1.358 . . . . 25.0 114.666 -177.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.95 134.7 55.3 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.039 0.536 . . . . 25.0 110.891 175.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 p -62.27 -33.88 75.48 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 115.19 1.552 . . . . 25.0 115.19 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 t -70.67 -8.22 50.33 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.145 0.498 . . . . 25.0 112.296 -178.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.721 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.9 m-85 -120.5 15.83 12.06 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 107.544 -1.28 . . . . 25.0 107.544 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -70.4 -40.48 73.87 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.146 -0.971 . . . . 25.0 111.739 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.59 -15.35 63.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.91 0.862 . . . . 25.0 109.942 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.721 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.65 -6.55 59.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.73 -0.841 . . . . 25.0 108.73 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -112.28 -33.73 6.12 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.236 0.828 . . . . 25.0 113.236 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -96.21 119.41 34.64 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 121.424 -0.798 . . . . 25.0 110.907 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -125.94 161.03 28.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.971 -1.013 . . . . 25.0 109.919 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 53.8 p -116.13 160.66 34.73 Favored Pre-proline 0 C--N 1.319 -0.747 1 N-CA-C 99.857 -4.127 . . . . 25.0 99.857 160.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -70.37 -0.49 7.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 116.995 -1.537 . . . . 25.0 115.794 -174.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.93 10.02 8.83 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.108 0.48 . . . . 25.0 111.471 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -78.49 -29.28 46.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.888 0.699 . . . . 25.0 112.888 -176.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.496 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 5.6 m95 -126.65 165.55 19.0 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.856 -0.424 . . . . 25.0 109.856 -179.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -67.22 131.4 45.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -100.03 105.45 17.12 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 101.325 -3.583 . . . . 25.0 101.325 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.7 136.25 52.6 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.929 -1.032 . . . . 25.0 111.057 -177.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -87.79 106.75 18.28 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.948 -1.024 . . . . 25.0 109.051 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.1 mt -132.38 173.73 10.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 157.94 23.32 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.768 -0.651 . . . . 25.0 110.843 -174.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.448 HG21 ' HA ' ' A' ' 139' ' ' ALA . 64.8 p -77.06 169.8 17.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.099 -1.445 . . . . 25.0 107.099 172.025 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 89.82 -160.35 28.67 Favored Glycine 0 C--O 1.239 0.439 0 N-CA-C 110.602 -0.999 . . . . 25.0 110.602 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.27 132.32 45.99 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 119.087 1.443 . . . . 25.0 114.218 -177.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.88 161.43 36.65 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.281 -1.748 . . . . 25.0 106.281 178.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 p -104.35 151.15 23.81 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.616 -1.254 . . . . 25.0 107.616 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -139.31 100.95 4.13 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.83 115.04 29.82 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 122.169 0.985 . . . . 25.0 109.483 -179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.7 m95 -101.17 148.43 25.1 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.964 -1.016 . . . . 25.0 109.701 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.9 111.1 13.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.215 -2.143 . . . . 25.0 105.215 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.73 128.49 56.44 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.619 0.768 . . . . 25.0 111.73 -173.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -32.61 23.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.315 0.579 . . . . 25.0 109.623 174.058 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.4 122.01 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.842 0.353 . . . . 25.0 110.54 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -82.59 3.33 29.15 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.78 152.98 44.47 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.653 -0.419 . . . . 25.0 109.997 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -68.99 156.0 39.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 114.308 1.225 . . . . 25.0 114.308 -171.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.408 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 13.4 t -96.88 159.78 14.73 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.181 -1.044 . . . . 25.0 108.181 173.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.9 t -117.86 -16.13 9.97 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 123.143 0.277 . . . . 25.0 110.442 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.53 160.2 4.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.207 0.527 . . . . 25.0 112.224 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -128.48 134.93 48.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.071 -2.566 . . . . 25.0 104.071 168.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -140.34 150.05 43.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.873 -0.788 . . . . 25.0 108.873 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.94 138.14 38.67 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.641 -1.614 . . . . 25.0 106.641 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -149.62 161.57 41.9 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.545 0.611 . . . . 25.0 110.305 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.96 163.29 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 114.014 1.116 . . . . 25.0 114.014 -169.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 21.9 p -77.73 164.19 25.48 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.238 -1.023 . . . . 25.0 108.238 171.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -64.3 159.75 55.65 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 107.838 -1.171 . . . . 25.0 107.838 176.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -68.57 -26.37 33.9 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 115.921 -2.253 . . . . 25.0 113.983 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -114.08 32.01 6.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.881 0.473 . . . . 25.0 111.037 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.471 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -68.39 168.85 11.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.05 0.929 . . . . 25.0 112.91 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -83.17 100.97 10.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.602 -1.181 . . . . 25.0 109.461 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.471 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -92.86 8.9 37.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.895 1.813 . . . . 25.0 115.895 -169.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.4 t -125.62 13.69 8.09 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.644 -0.872 . . . . 25.0 108.644 177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -116.94 158.61 43.57 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.281 -1.327 . . . . 25.0 107.677 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -65.69 152.7 80.93 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 118.22 -0.72 . . . . 25.0 111.248 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mp -69.53 101.97 1.72 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.786 0.661 . . . . 25.0 112.786 -175.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.3 p -95.44 153.75 17.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.876 -1.157 . . . . 25.0 107.876 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -64.13 -24.51 67.72 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.065 0.459 . . . . 25.0 111.559 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.4 -26.79 67.41 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 25.0 112.415 177.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -80.59 -6.57 58.48 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.598 0.592 . . . . 25.0 112.598 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 50.5 m-85 -105.41 157.51 17.3 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -175.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.14 96.25 7.98 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 102.606 -3.109 . . . . 25.0 102.606 162.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.98 -6.82 24.24 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.938 1.459 . . . . 25.0 114.938 -169.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.4 t -79.88 133.47 58.34 Favored Pre-proline 0 C--N 1.321 -0.635 0 N-CA-C 108.995 -0.742 . . . . 25.0 108.995 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -72.37 148.38 48.73 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 114.824 -2.984 . . . . 25.0 110.596 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -102.67 -8.32 21.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.032 0.444 . . . . 25.0 111.277 -179.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.23 68.86 1.04 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.962 -0.563 . . . . 25.0 109.894 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -88.93 129.39 35.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 119.488 -0.885 . . . . 25.0 108.931 177.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -121.45 98.98 6.22 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 104.272 -2.492 . . . . 25.0 104.272 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -90.99 92.01 8.57 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.014 -1.106 . . . . 25.0 108.014 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -110.77 117.42 33.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.994 -1.484 . . . . 25.0 106.994 175.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.18 82.72 0.35 Allowed Glycine 0 CA--C 1.501 -0.819 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.717 -170.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 122.64 13.19 4.74 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 120.98 -0.628 . . . . 25.0 113.812 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.28 104.04 5.69 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.7 mt -74.76 122.83 88.35 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.51 156.8 49.61 Favored 'Trans proline' 0 C--N 1.345 0.389 0 N-CA-C 114.503 0.924 . . . . 25.0 114.503 -176.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -99.14 29.39 3.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 73.56 -15.89 0.53 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.881 1.673 . . . . 25.0 112.601 -176.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -130.55 148.97 52.41 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.5 t -142.48 94.96 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 106.996 -1.483 . . . . 25.0 106.996 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.1 t -88.71 136.89 32.77 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.9 166.94 23.27 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 106.12 -1.807 . . . . 25.0 106.12 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -133.46 152.87 51.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.415 -2.069 . . . . 25.0 105.415 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.65 159.54 33.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.795 -1.187 . . . . 25.0 107.795 -178.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -105.29 115.52 30.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.737 0.273 . . . . 25.0 111.737 -175.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.79 132.6 64.03 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 108.753 -0.832 . . . . 25.0 108.753 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -61.66 146.81 96.51 Favored 'Trans proline' 0 C--N 1.354 0.864 0 N-CA-C 113.682 0.609 . . . . 25.0 113.682 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.448 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.57 -29.56 41.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.98 -168.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -81.88 7.07 13.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.584 -0.735 . . . . 25.0 110.594 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.1 mmt-85 -114.03 51.9 0.85 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.027 -1.101 . . . . 25.0 108.027 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.09 170.96 11.73 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.557 -1.645 . . . . 25.0 106.557 175.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 86.89 -167.37 38.17 Favored Glycine 0 C--N 1.321 -0.263 0 N-CA-C 116.213 1.245 . . . . 25.0 116.213 176.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.4 t -86.03 106.91 17.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.41 0.624 . . . . 25.0 110.985 -168.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -158.2 171.25 20.54 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.907 -0.588 . . . . 25.0 111.623 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -105.7 150.22 8.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 64.2 mt -131.94 122.84 50.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -106.88 132.96 52.24 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.192 -0.913 . . . . 25.0 109.998 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.4 137.73 54.43 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 122.905 0.482 . . . . 25.0 109.76 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.6 p -128.8 138.0 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 114.04 1.126 . . . . 25.0 114.04 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.408 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.3 t90 -98.44 121.6 40.59 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 105.086 -2.191 . . . . 25.0 105.086 170.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -106.17 119.35 39.01 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.815 -1.18 . . . . 25.0 107.815 -176.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 22.2 mm -84.71 137.97 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 122.031 -0.418 . . . . 25.0 112.092 -171.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -77.9 -45.12 25.01 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.57 -0.706 . . . . 25.0 111.094 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.22 -25.9 65.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.697 1.369 . . . . 25.0 114.697 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 69.6 p -139.31 165.9 25.96 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.444 0.64 . . . . 25.0 109.607 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.62 29.84 0.25 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.555 -0.748 . . . . 25.0 112.642 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -99.05 147.94 24.53 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -177.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.32 144.94 12.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 171.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -146.75 130.62 17.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.996 0.369 . . . . 25.0 111.996 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -91.7 118.08 30.34 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.527 0.517 . . . . 25.0 110.776 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -97.17 116.74 29.93 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.875 -1.158 . . . . 25.0 107.875 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.82 140.16 29.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.951 -0.568 . . . . 25.0 112.117 -176.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -126.93 134.31 66.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 105.945 -1.872 . . . . 25.0 105.945 167.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -94.08 130.43 40.24 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 176.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.1 m -132.06 162.8 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 113.08 0.77 . . . . 25.0 113.08 -174.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -118.06 95.11 4.76 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.78 163.9 14.29 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.008 -0.542 . . . . 25.0 112.109 -172.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 63.3 p -143.83 151.82 40.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.686 -0.487 . . . . 25.0 109.686 175.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 117.791 -1.099 . . . . 25.0 112.345 -176.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.496 0.665 . . . . 25.0 110.389 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 170.61 36.62 Favored Glycine 0 CA--C 1.508 -0.395 1 N-CA-C 101.375 -4.69 . . . . 25.0 101.375 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -147.85 164.78 32.6 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 120.402 2.101 . . . . 25.0 110.336 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -101.03 122.3 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 107.639 -1.245 . . . . 25.0 107.639 176.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.61 -42.36 61.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.72 -1.127 . . . . 25.0 109.974 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 t -153.34 129.5 5.36 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 164' ' ' ILE . 68.0 Cg_endo -64.76 133.81 17.78 Favored 'Cis proline' 0 CA--C 1.533 0.464 0 C-N-CA 128.791 0.746 . . . . 25.0 111.103 -0.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 110.49 3.21 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.576 0.584 . . . . 25.0 112.576 -172.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.2 t -71.94 157.17 38.33 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.2 mtp180 -55.42 -24.98 33.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.478 0.711 . . . . 25.0 112.272 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.76 -53.99 38.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.826 0.822 . . . . 25.0 109.539 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -68.26 -33.06 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.501 -0.772 . . . . 25.0 110.818 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.9 -33.17 74.74 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 122.009 -0.432 . . . . 25.0 110.449 177.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -65.59 -38.99 91.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.72 -0.474 . . . . 25.0 109.72 178.325 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -64.48 -36.75 85.21 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.202 0.525 . . . . 25.0 110.263 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -78.22 5.8 9.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.037 -0.528 . . . . 25.0 111.473 177.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 58.73 25.74 13.78 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.137 1.375 . . . . 25.0 112.751 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -91.78 -18.88 23.22 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -122.35 158.25 30.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.9 p -133.93 175.23 9.65 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 122.866 0.466 . . . . 25.0 109.956 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 68.12 5.29 4.55 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.848 1.796 . . . . 25.0 115.848 175.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.1 m -68.66 -35.37 77.15 Favored 'General case' 0 CA--C 1.504 -0.811 0 O-C-N 121.601 -0.687 . . . . 25.0 112.025 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.42 -62.96 1.83 Allowed Glycine 0 C--O 1.22 -0.743 0 O-C-N 123.813 0.695 . . . . 25.0 111.804 -177.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -88.01 -50.1 6.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 114.74 1.385 . . . . 25.0 114.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 25' ' ' VAL . 2.1 t -65.08 -13.07 14.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 114.549 -1.205 . . . . 25.0 114.146 -165.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -82.59 -9.97 59.17 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.24 -0.984 . . . . 25.0 111.563 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -105.99 -34.09 7.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.266 -0.574 . . . . 25.0 109.479 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -127.1 98.9 29.29 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.638 -0.255 . . . . 25.0 111.246 172.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.16 -21.58 20.2 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 117.281 -1.346 . . . . 25.0 113.907 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -87.97 15.26 7.49 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.193 0.442 . . . . 25.0 112.193 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.8 m -61.62 -25.27 67.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.973 0.416 . . . . 25.0 111.874 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.94 117.93 5.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 115.514 1.672 . . . . 25.0 115.514 -173.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -152.95 157.28 40.36 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 105.231 -2.137 . . . . 25.0 105.231 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.76 -164.79 16.32 Favored Glycine 0 CA--C 1.51 -0.278 0 N-CA-C 108.656 -1.778 . . . . 25.0 108.656 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -118.15 149.79 40.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.432 1.116 . . . . 25.0 112.6 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.88 156.99 31.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.012 -1.107 . . . . 25.0 108.012 171.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.55 -2.77 1.77 Allowed Glycine 0 C--O 1.225 -0.459 0 CA-C-N 114.671 -1.149 . . . . 25.0 113.418 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.69 140.68 71.53 Favored Pre-proline 0 C--N 1.323 -0.571 0 O-C-N 121.518 -0.99 . . . . 25.0 110.676 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -92.84 -14.15 19.83 Favored 'Cis proline' 0 CA--C 1.543 0.937 0 C-N-CA 130.195 1.331 . . . . 25.0 115.243 -7.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -71.79 -36.87 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.193 1.553 . . . . 25.0 115.193 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.17 34.07 5.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.5 -174.62 44.64 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 114.533 -1.212 . . . . 25.0 111.717 -176.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.53 172.67 1.9 Allowed 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 123.663 2.909 . . . . 25.0 112.85 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.16 159.96 30.99 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 106.858 -1.534 . . . . 25.0 106.858 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.04 140.76 55.41 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.097 -1.446 . . . . 25.0 107.097 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.23 -6.93 77.87 Favored Glycine 0 C--O 1.23 -0.114 0 C-N-CA 121.294 -0.479 . . . . 25.0 112.958 -174.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -124.89 9.68 8.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.376 -0.485 . . . . 25.0 109.847 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.9 mt -66.98 -50.75 61.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 122.044 -0.41 . . . . 25.0 111.405 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.06 -21.38 59.95 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.92 -0.488 . . . . 25.0 109.839 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.6 p -82.66 -9.46 59.37 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.844 -0.343 . . . . 25.0 111.821 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.29 37.61 19.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.721 0.808 . . . . 25.0 110.416 -172.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.6 t70 63.12 32.59 15.11 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.736 1.384 . . . . 25.0 114.736 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -118.97 134.54 55.12 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.785 -0.572 . . . . 25.0 111.973 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 p -62.82 -35.09 78.78 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 115.717 1.747 . . . . 25.0 115.717 -173.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.76 -8.03 49.33 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.254 0.549 . . . . 25.0 112.05 -178.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.688 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.0 m-85 -121.38 14.71 11.23 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 107.734 -1.21 . . . . 25.0 107.734 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -69.16 -41.14 77.63 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.108 -0.995 . . . . 25.0 111.038 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -73.87 -11.25 60.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.913 0.863 . . . . 25.0 109.675 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.688 HD13 ' HA ' ' A' ' 56' ' ' PHE . 3.0 mp -86.2 -3.43 58.97 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -114.48 -32.87 5.77 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.02 0.378 . . . . 25.0 112.02 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -97.46 120.66 38.23 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 121.477 -0.764 . . . . 25.0 110.299 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.418 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -125.83 160.97 28.46 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.316 -0.857 . . . . 25.0 109.684 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.5 p -114.99 161.19 30.53 Favored Pre-proline 0 C--N 1.318 -0.768 1 N-CA-C 99.58 -4.23 . . . . 25.0 99.58 160.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.57 -2.64 10.39 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 116.823 -1.651 . . . . 25.0 116.127 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -126.1 11.49 7.63 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.754 0.787 . . . . 25.0 111.282 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -79.59 -29.86 41.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.276 -0.89 . . . . 25.0 112.969 -176.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.418 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.1 m95 -125.6 167.01 15.68 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 110.022 -0.362 . . . . 25.0 110.022 -177.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -68.2 125.7 27.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 172.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -99.22 106.12 18.24 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 100.202 -3.999 . . . . 25.0 100.202 176.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.85 135.12 52.03 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.175 -0.92 . . . . 25.0 110.495 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -89.77 100.68 13.44 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.848 -1.167 . . . . 25.0 107.848 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.3 mt -131.28 174.03 10.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.244 -1.021 . . . . 25.0 108.244 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.67 155.6 24.19 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.478 -0.783 . . . . 25.0 111.666 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 54.2 p -77.28 167.21 22.1 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 172.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.97 -162.08 22.87 Favored Glycine 0 C--O 1.241 0.553 0 N-CA-C 110.712 -0.955 . . . . 25.0 110.712 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 133.87 56.65 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 118.958 1.379 . . . . 25.0 114.043 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.42 159.54 41.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.45 -1.685 . . . . 25.0 106.45 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.8 p -106.12 152.97 22.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 106.923 -1.51 . . . . 25.0 106.923 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -138.28 101.06 4.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 105.238 -2.134 . . . . 25.0 105.238 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.1 107.78 20.34 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.865 0.84 . . . . 25.0 110.114 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -97.21 146.47 25.06 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.426 -0.806 . . . . 25.0 110.074 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -124.89 112.11 16.24 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.67 108.5 17.98 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.437 -0.801 . . . . 25.0 111.225 -172.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -71.69 -32.73 68.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.443 0.639 . . . . 25.0 109.861 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.49 117.56 23.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.495 -0.557 . . . . 25.0 109.495 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -72.64 -5.73 39.46 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.654 1.353 . . . . 25.0 114.654 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.94 156.61 23.96 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -72.87 156.03 39.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 113.762 1.023 . . . . 25.0 113.762 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 12.4 t -99.96 157.67 16.37 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.527 -0.916 . . . . 25.0 108.527 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -118.12 -14.7 9.91 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.117 0.261 . . . . 25.0 111.617 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.7 t -172.58 152.66 2.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.849 0.356 . . . . 25.0 111.51 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 51.5 m95 -122.92 138.91 54.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 104.599 -2.371 . . . . 25.0 104.599 167.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -143.49 147.03 33.9 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -136.15 132.86 36.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.169 -1.789 . . . . 25.0 106.169 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.83 161.8 41.1 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.446 0.566 . . . . 25.0 110.197 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.29 165.96 30.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 113.427 0.899 . . . . 25.0 113.427 -167.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 17.0 p -80.36 160.3 25.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.49 -1.3 . . . . 25.0 107.49 169.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -61.89 159.41 36.3 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.29 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 -24.36 34.51 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 116.256 -2.029 . . . . 25.0 114.234 -173.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -114.43 32.05 6.21 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.398 . . . . 25.0 111.358 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -74.15 166.99 22.46 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.952 0.882 . . . . 25.0 112.87 -176.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -83.0 100.99 10.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.683 -1.144 . . . . 25.0 110.031 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.31 15.46 10.47 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 116.421 2.008 . . . . 25.0 116.421 -169.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.7 t -124.29 9.03 8.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.814 -0.81 . . . . 25.0 108.814 175.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -112.52 158.44 37.35 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 114.544 -1.207 . . . . 25.0 108.077 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.82 154.61 71.96 Favored 'Trans proline' 0 C--N 1.347 0.481 0 O-C-N 121.863 0.401 . . . . 25.0 111.953 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.05 105.14 3.8 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.364 0.602 . . . . 25.0 111.046 -177.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.6 p -94.04 154.43 17.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -63.59 -26.58 68.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.035 -0.415 . . . . 25.0 111.639 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.07 62.65 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.714 177.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.0 t -76.73 -20.79 56.13 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.627 0.727 . . . . 25.0 111.305 -178.206 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.421 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 55.8 m-85 -88.21 154.95 20.02 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 115.134 1.531 . . . . 25.0 115.134 -176.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -92.3 95.85 9.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 102.301 -3.222 . . . . 25.0 102.301 161.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 79.9 mt -66.96 -6.85 18.42 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.77 1.396 . . . . 25.0 114.77 -169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.0 t -85.97 130.35 50.71 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.314 -0.995 . . . . 25.0 108.314 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.93 148.99 52.55 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 115.509 -2.528 . . . . 25.0 111.457 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -100.07 -9.1 22.99 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.123 0.487 . . . . 25.0 111.266 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.0 m -149.23 69.48 1.06 Allowed 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.943 -0.571 . . . . 25.0 109.561 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -88.99 134.58 33.93 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.566 -0.854 . . . . 25.0 109.185 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.51 99.04 5.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 105.849 -1.908 . . . . 25.0 105.849 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -91.98 92.08 8.14 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -105.14 118.34 36.28 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 106.796 -1.557 . . . . 25.0 106.796 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.27 79.9 0.47 Allowed Glycine 0 CA--C 1.502 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 114.082 -167.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.84 22.44 6.63 Favored Glycine 0 C--N 1.32 -0.361 0 C-N-CA 120.861 -0.685 . . . . 25.0 112.61 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.27 105.68 5.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.415 0.626 . . . . 25.0 109.343 177.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.49 122.78 87.56 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 105.596 -2.001 . . . . 25.0 105.596 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.73 168.11 24.19 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 117.714 -1.057 . . . . 25.0 113.872 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.99 24.29 4.36 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.693 -0.855 . . . . 25.0 108.693 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.83 -17.97 0.28 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.843 1.657 . . . . 25.0 112.602 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -129.06 148.04 50.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 104.028 -2.582 . . . . 25.0 104.028 170.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.86 94.95 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.049 -1.463 . . . . 25.0 107.049 -178.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.4 m -85.71 100.06 11.74 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 107.894 -1.15 . . . . 25.0 107.894 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.08 166.53 11.55 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.303 -1.369 . . . . 25.0 107.303 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -134.64 153.58 51.91 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 170.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -164.38 160.59 20.93 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.922 -1.14 . . . . 25.0 107.922 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -105.21 117.26 33.56 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.172 0.295 . . . . 25.0 110.948 -176.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.14 130.95 67.77 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 107.924 -1.139 . . . . 25.0 107.924 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -62.2 147.31 95.26 Favored 'Trans proline' 0 C--N 1.353 0.793 0 CA-C-O 121.682 0.617 . . . . 25.0 113.402 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.418 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.11 -25.65 36.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.222 -0.899 . . . . 25.0 112.653 -169.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 p-10 -83.76 9.4 11.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.698 0.761 . . . . 25.0 110.225 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -115.13 53.3 0.83 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.189 -1.041 . . . . 25.0 108.189 171.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 32.3 p -86.11 166.69 15.6 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 106.414 -1.699 . . . . 25.0 106.414 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.16 -166.76 35.41 Favored Glycine 0 C--N 1.319 -0.384 0 N-CA-C 115.459 0.944 . . . . 25.0 115.459 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.01 108.31 18.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.488 0.661 . . . . 25.0 110.938 -168.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.411 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.9 p-80 -156.94 171.18 20.91 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.834 -0.621 . . . . 25.0 110.819 -176.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 p -107.8 150.6 10.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 49.8 mt -131.5 120.1 44.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.489 -2.041 . . . . 25.0 105.489 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.56 132.73 51.36 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.04 135.1 50.33 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.993 -0.373 . . . . 25.0 109.993 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.7 p -122.01 144.2 32.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 122.075 0.941 . . . . 25.0 112.572 -177.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.6 t90 -112.48 105.62 13.9 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.173 -2.158 . . . . 25.0 105.173 173.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.17 127.37 35.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.569 -1.271 . . . . 25.0 107.569 179.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.0 mm -83.62 140.68 15.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.768 -0.456 . . . . 25.0 109.768 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.38 -42.78 24.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.353 0.597 . . . . 25.0 110.477 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.13 -24.62 65.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.734 1.012 . . . . 25.0 113.734 -172.209 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.6 p -139.49 171.21 14.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.999 0.904 . . . . 25.0 110.206 -174.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.6 20.21 0.74 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.239 -0.891 . . . . 25.0 112.209 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -90.1 146.48 24.28 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.057 0.762 . . . . 25.0 113.057 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.06 144.61 11.48 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -147.95 127.19 12.98 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -84.34 117.13 23.4 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.04 0.448 . . . . 25.0 110.732 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -97.1 112.53 24.26 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.81 141.02 29.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.432 -0.804 . . . . 25.0 111.869 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.6 tt -125.15 134.87 65.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 105.607 -1.997 . . . . 25.0 105.607 166.373 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -93.65 131.25 39.14 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.885 -1.524 . . . . 25.0 106.885 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.4 m -132.5 161.24 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.652 0.612 . . . . 25.0 112.652 -175.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.68 95.05 4.68 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 103.729 -2.693 . . . . 25.0 103.729 167.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.4 tp -90.4 163.18 14.78 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 112.558 0.577 . . . . 25.0 112.558 -171.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 74.9 p -145.88 164.09 33.04 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.493 -0.929 . . . . 25.0 108.493 177.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.069 -0.967 . . . . 25.0 110.515 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.0 m80 . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.356 0.598 . . . . 25.0 110.473 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.22 169.58 35.84 Favored Glycine 0 C--N 1.32 -0.348 1 N-CA-C 101.077 -4.809 . . . . 25.0 101.077 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.469 ' HA ' HE22 ' A' ' 162' ' ' GLN . 36.7 p90 -143.97 165.71 27.0 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 120.124 1.962 . . . . 25.0 110.2 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -102.46 121.23 53.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 106.17 -1.789 . . . . 25.0 106.17 176.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -74.04 -41.43 61.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.53 -1.213 . . . . 25.0 109.553 -174.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -154.17 129.22 4.97 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 105.987 -1.857 . . . . 25.0 105.987 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -65.28 131.56 13.29 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 128.828 0.761 . . . . 25.0 111.543 -0.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 113.15 4.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.996 -0.547 . . . . 25.0 111.594 -173.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.4 p -72.13 163.71 27.44 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.273 -0.639 . . . . 25.0 109.273 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -59.73 -21.86 61.25 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.146 0.498 . . . . 25.0 111.797 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.28 -53.68 27.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.934 -0.765 . . . . 25.0 108.934 174.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.01 -35.81 81.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.684 -0.689 . . . . 25.0 110.759 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.41 -32.62 74.32 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.13 -0.356 . . . . 25.0 111.024 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 25.0 109.839 177.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -66.77 -36.09 81.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.141 0.496 . . . . 25.0 109.864 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.97 3.61 11.84 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.357 -0.383 . . . . 25.0 111.964 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 58.53 21.84 9.03 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.094 1.357 . . . . 25.0 112.836 -178.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -84.72 -21.17 30.19 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.284 -1.376 . . . . 25.0 107.284 173.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 -123.19 157.73 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 104.736 -2.32 . . . . 25.0 104.736 176.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 p -135.26 176.67 8.46 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.575 -0.528 . . . . 25.0 109.575 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 69.83 5.05 5.04 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.536 1.68 . . . . 25.0 115.536 174.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -68.06 -38.84 82.91 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 121.402 -0.811 . . . . 25.0 110.844 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.32 -63.81 1.74 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.683 0.614 . . . . 25.0 112.037 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -87.97 -52.45 5.26 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 122.503 1.144 . . . . 25.0 111.889 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.469 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.8 OUTLIER -67.86 -11.82 14.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.469 -1.241 . . . . 25.0 113.248 -171.83 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -85.6 -1.44 57.13 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 121.739 -0.601 . . . . 25.0 111.487 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.41 -34.08 4.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.056 -0.657 . . . . 25.0 110.349 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -127.04 95.79 35.99 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 120.7 0.286 . . . . 25.0 110.349 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' HG12 ' A' ' 25' ' ' VAL . 82.7 Cg_endo -70.63 -19.39 32.04 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 115.05 1.134 . . . . 25.0 115.05 -177.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -87.02 10.92 14.96 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.772 -0.58 . . . . 25.0 112.404 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.9 m -62.52 -18.29 61.64 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.559 0.577 . . . . 25.0 112.559 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.1 m -64.13 122.35 14.86 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 114.875 1.435 . . . . 25.0 114.875 -175.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -153.04 155.23 36.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.601 -1.629 . . . . 25.0 106.601 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.62 -167.09 19.77 Favored Glycine 0 CA--C 1.512 -0.123 0 N-CA-C 107.838 -2.105 . . . . 25.0 107.838 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 tp -117.93 149.77 40.35 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.536 1.168 . . . . 25.0 111.891 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -65.02 156.93 29.81 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.36 -1.348 . . . . 25.0 107.36 171.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.89 4.57 2.98 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-N 114.848 -1.069 . . . . 25.0 113.73 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -75.99 143.22 73.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 121.528 -0.983 . . . . 25.0 109.263 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.22 -16.93 17.24 Favored 'Cis proline' 0 CA--C 1.543 0.934 0 N-CA-C 115.635 1.36 . . . . 25.0 115.635 -5.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -70.85 -37.75 73.15 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.95 1.463 . . . . 25.0 114.95 -169.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -113.26 28.47 8.76 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.067 -1.827 . . . . 25.0 106.067 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.09 -176.43 45.06 Favored Glycine 0 N--CA 1.445 -0.702 0 CA-C-N 114.567 -1.197 . . . . 25.0 110.692 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.59 175.17 1.77 Allowed 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 123.781 2.987 . . . . 25.0 113.222 177.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.04 160.03 31.01 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.683 -1.599 . . . . 25.0 106.683 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.25 140.07 57.23 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 175.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.33 -5.9 83.26 Favored Glycine 0 C--O 1.229 -0.212 0 CA-C-O 121.349 0.416 . . . . 25.0 112.785 -174.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 60.1 m170 -125.76 8.88 7.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.453 -0.44 . . . . 25.0 110.962 178.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.8 mt -64.52 -46.8 91.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 121.915 -0.491 . . . . 25.0 110.968 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.39 -12.09 59.98 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.078 -0.389 . . . . 25.0 110.482 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 p -94.0 -7.58 42.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.01 33.97 12.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.555 0.742 . . . . 25.0 110.758 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 61.38 32.55 19.06 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.339 1.237 . . . . 25.0 114.339 -178.314 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -118.46 137.61 53.05 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.124 0.488 . . . . 25.0 111.608 176.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.85 -34.88 78.27 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 115.233 1.568 . . . . 25.0 115.233 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.5 t -71.46 -7.41 47.26 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.27 0.557 . . . . 25.0 112.468 -177.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.682 ' HA ' HD13 ' A' ' 59' ' ' LEU . 16.3 m-85 -120.37 12.5 11.69 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 107.161 -1.422 . . . . 25.0 107.161 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -72.12 -35.08 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.081 -1.012 . . . . 25.0 110.171 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mp0 -70.08 -16.56 63.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.897 0.856 . . . . 25.0 109.864 175.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.682 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.3 mp -87.42 -5.93 58.64 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 -176.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -114.14 -31.96 6.16 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 112.384 0.513 . . . . 25.0 112.384 174.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -95.1 118.15 31.41 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.539 -0.726 . . . . 25.0 110.342 -178.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.436 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -126.38 161.01 28.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.109 -0.701 . . . . 25.0 109.109 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.1 p -118.81 161.6 35.28 Favored Pre-proline 0 C--N 1.317 -0.813 0 N-CA-C 100.245 -3.983 . . . . 25.0 100.245 162.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.4 -5.09 15.13 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 116.728 -1.715 . . . . 25.0 115.588 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.4 t -123.66 10.03 9.0 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.063 0.459 . . . . 25.0 111.71 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -79.07 -30.46 43.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.724 0.638 . . . . 25.0 112.724 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.436 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 14.5 m95 -123.51 165.78 16.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 120.698 0.285 . . . . 25.0 110.516 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -67.72 129.17 39.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 105.471 -2.048 . . . . 25.0 105.471 169.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -100.15 105.84 17.49 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 101.249 -3.612 . . . . 25.0 101.249 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.75 135.79 54.51 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.819 -1.082 . . . . 25.0 109.93 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -93.43 106.17 18.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.826 -1.079 . . . . 25.0 109.091 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -131.64 173.71 10.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.655 -1.239 . . . . 25.0 107.655 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.73 157.34 23.32 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.727 -0.669 . . . . 25.0 110.421 -176.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.454 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.8 p -77.28 166.76 22.77 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.921 -1.511 . . . . 25.0 106.921 173.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.52 -161.78 23.18 Favored Glycine 0 C--O 1.241 0.539 0 N-CA-C 110.336 -1.106 . . . . 25.0 110.336 -177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.23 132.54 47.33 Favored 'Trans proline' 0 C--N 1.346 0.408 0 CA-C-N 119.147 1.473 . . . . 25.0 114.288 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -138.93 161.31 37.64 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.1 p -103.43 150.91 23.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -138.15 100.92 4.27 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.467 -2.049 . . . . 25.0 105.467 -178.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.78 116.13 31.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 122.041 0.924 . . . . 25.0 110.023 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -100.48 149.2 23.93 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.151 -0.931 . . . . 25.0 109.85 178.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -127.92 115.05 17.96 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.494 -2.409 . . . . 25.0 104.494 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -114.37 121.93 45.13 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.101 -0.954 . . . . 25.0 110.791 -172.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.4 t -74.48 -29.72 61.55 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.51 0.671 . . . . 25.0 110.141 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.62 133.38 35.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.03 0.443 . . . . 25.0 110.856 -177.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -77.92 -5.77 52.18 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.748 0.648 . . . . 25.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -63.97 156.86 26.6 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.353 0.872 . . . . 25.0 113.353 -175.329 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.4 t -77.63 155.97 31.08 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.561 1.319 . . . . 25.0 114.561 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -103.67 156.23 17.95 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.024 -0.535 . . . . 25.0 109.711 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -118.03 -14.81 9.96 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.227 0.454 . . . . 25.0 112.227 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.4 t -172.54 154.1 3.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.976 0.417 . . . . 25.0 111.525 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.3 m95 -128.06 134.73 49.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.83 -2.285 . . . . 25.0 104.83 168.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -141.0 149.61 41.99 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.373 -0.973 . . . . 25.0 108.373 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -137.95 135.29 35.89 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 105.731 -1.951 . . . . 25.0 105.731 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.98 160.9 42.88 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.183 0.447 . . . . 25.0 109.938 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.35 166.5 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 112.736 0.643 . . . . 25.0 112.736 -167.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 p -79.6 158.7 27.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -62.32 158.91 44.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.109 -0.95 . . . . 25.0 109.859 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.52 -15.64 38.11 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 117.894 -0.937 . . . . 25.0 114.179 -174.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -118.66 32.06 6.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.721 0.408 . . . . 25.0 111.882 -176.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.52 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -79.14 161.58 26.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.819 0.819 . . . . 25.0 112.076 -177.208 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -83.11 101.03 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.703 -1.135 . . . . 25.0 110.098 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.52 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -83.98 16.68 2.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 116.928 2.195 . . . . 25.0 116.928 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -123.87 5.16 8.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.587 0.708 . . . . 25.0 109.179 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -108.71 157.45 36.68 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 114.838 -1.074 . . . . 25.0 108.499 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.71 154.9 70.08 Favored 'Trans proline' 0 C--N 1.346 0.415 0 O-C-N 121.968 0.457 . . . . 25.0 112.695 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.26 112.25 9.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.321 0.581 . . . . 25.0 110.945 -177.028 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.8 p -104.7 156.8 17.66 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -63.82 -27.04 68.9 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 122.087 -0.383 . . . . 25.0 111.735 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -25.16 61.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.91 -0.586 . . . . 25.0 112.075 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.2 t -78.29 -20.43 51.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.177 0.513 . . . . 25.0 111.149 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -89.78 153.86 20.36 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 115.077 1.51 . . . . 25.0 115.077 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -90.8 97.93 11.47 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 103.133 -2.914 . . . . 25.0 103.133 162.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -67.46 -5.87 16.86 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.82 1.415 . . . . 25.0 114.82 -170.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -88.44 128.64 52.27 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.206 -1.035 . . . . 25.0 108.206 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.04 145.73 50.5 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.325 -2.65 . . . . 25.0 111.422 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -95.17 -9.13 34.32 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.916 0.389 . . . . 25.0 111.788 -177.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 55.6 m -151.39 69.35 0.94 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.082 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.15 133.57 34.35 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 118.775 -1.17 . . . . 25.0 109.858 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.36 99.06 6.27 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -93.26 92.07 7.54 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 107.229 -1.397 . . . . 25.0 107.229 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -108.81 118.36 36.6 Favored 'General case' 0 C--O 1.216 -0.675 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 178.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -93.61 76.63 1.09 Allowed Glycine 0 CA--C 1.503 -0.705 0 CA-C-N 115.434 -0.803 . . . . 25.0 114.772 -168.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 105.11 25.34 6.79 Favored Glycine 0 C--N 1.319 -0.388 0 C-N-CA 121.011 -0.614 . . . . 25.0 113.122 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.89 106.35 3.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.649 0.738 . . . . 25.0 109.724 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.05 123.72 88.8 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 106.712 -1.588 . . . . 25.0 106.712 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.33 172.41 15.4 Favored 'Trans proline' 0 C--N 1.344 0.327 0 N-CA-C 113.887 0.687 . . . . 25.0 113.887 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.407 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -99.53 27.68 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.017 -1.105 . . . . 25.0 108.017 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.24 -9.84 0.58 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.622 1.569 . . . . 25.0 112.129 -173.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' A' ' 128' ' ' ALA . 60.8 mt-30 -131.48 151.65 51.39 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 103.849 -2.649 . . . . 25.0 103.849 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -142.1 95.18 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 106.924 -1.51 . . . . 25.0 106.924 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.5 t -94.37 126.88 39.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 107.179 -1.415 . . . . 25.0 107.179 175.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -133.17 166.92 21.33 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 105.299 -2.111 . . . . 25.0 105.299 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -131.33 151.07 51.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 173.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.07 158.95 37.39 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.791 -1.189 . . . . 25.0 107.791 -177.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -102.21 116.17 32.1 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.091 0.245 . . . . 25.0 111.15 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.8 mt -76.91 131.26 73.65 Favored Pre-proline 0 C--O 1.241 0.606 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.37 146.41 97.26 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-O 121.655 0.606 . . . . 25.0 113.527 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.01 -26.24 36.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.186 -0.915 . . . . 25.0 112.588 -168.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -84.31 10.78 9.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 25.0 110.172 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.5 mmt-85 -116.15 50.65 1.02 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.45 -0.944 . . . . 25.0 108.45 171.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.0 p -85.86 164.63 17.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.491 -1.3 . . . . 25.0 107.491 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.69 -166.91 31.81 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 114.648 0.619 . . . . 25.0 114.648 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.3 t -86.02 112.43 21.22 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.353 0.596 . . . . 25.0 110.354 -169.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -159.46 172.27 18.2 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.711 -0.677 . . . . 25.0 110.317 -176.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.07 151.69 10.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.3 mt -133.13 122.32 45.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 104.895 -2.261 . . . . 25.0 104.895 -178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.41 134.55 50.3 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.557 -0.747 . . . . 25.0 109.919 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -125.12 134.44 52.45 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.791 0.436 . . . . 25.0 110.078 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.21 142.91 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 122.322 1.058 . . . . 25.0 112.438 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -111.49 114.58 27.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 105.737 -1.949 . . . . 25.0 105.737 173.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -94.69 122.31 37.16 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.842 -1.17 . . . . 25.0 107.842 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.5 mm -78.69 142.42 14.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.543 -0.54 . . . . 25.0 109.543 -177.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.54 -42.94 21.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.924 0.784 . . . . 25.0 110.108 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -23.89 64.79 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.649 0.981 . . . . 25.0 113.649 -172.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.3 p -139.09 168.61 19.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.901 0.858 . . . . 25.0 109.988 -175.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.24 21.39 0.75 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.285 -0.871 . . . . 25.0 112.334 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -90.7 147.27 23.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.35 143.41 11.94 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 105.916 -1.883 . . . . 25.0 105.916 173.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -148.07 128.54 14.02 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.72 0.267 . . . . 25.0 111.72 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -86.96 117.76 25.9 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 120.74 0.305 . . . . 25.0 110.859 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' GLN . . . . . 0.469 HE22 ' HA ' ' A' ' 3' ' ' TYR . 78.0 mt-30 -97.24 118.7 34.27 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 176.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -87.89 142.5 27.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.713 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.85 134.85 65.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 105.298 -2.112 . . . . 25.0 105.298 166.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.71 129.54 42.89 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 177.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -132.97 162.11 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 113.454 0.909 . . . . 25.0 113.454 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -117.89 95.11 4.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 104.56 -2.385 . . . . 25.0 104.56 168.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.14 163.66 14.76 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 112.397 0.517 . . . . 25.0 112.397 -173.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.3 p -145.74 162.95 36.42 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.896 -1.15 . . . . 25.0 107.896 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 117.96 -1.019 . . . . 25.0 110.879 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 21.5 m80 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 121.341 0.591 . . . . 25.0 110.602 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.43 164.46 30.52 Favored Glycine 0 C--N 1.321 -0.262 1 N-CA-C 99.904 -5.278 . . . . 25.0 99.904 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -145.6 162.03 38.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.968 2.384 . . . . 25.0 111.625 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.01 121.62 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 107.95 -1.129 . . . . 25.0 107.95 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -76.02 -42.78 46.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.456 -1.247 . . . . 25.0 109.809 -175.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.2 t -152.86 128.83 5.19 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 106.154 -1.795 . . . . 25.0 106.154 177.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.99 131.74 11.89 Favored 'Cis proline' 0 CA--C 1.534 0.483 0 C-N-CA 128.771 0.738 . . . . 25.0 111.193 -0.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.44 112.61 4.15 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 25.0 112.242 -171.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.9 t -71.97 157.82 37.12 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.378 -0.971 . . . . 25.0 108.378 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -56.12 -24.24 39.46 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.478 0.711 . . . . 25.0 111.826 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.7 -53.09 37.33 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.736 0.779 . . . . 25.0 109.337 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -66.86 -36.72 82.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.599 -0.728 . . . . 25.0 110.482 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -63.38 -31.02 72.07 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.985 -0.286 . . . . 25.0 110.755 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -40.63 95.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.192 0.52 . . . . 25.0 110.276 178.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.485 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.4 tmtm? -70.19 -33.55 71.86 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.04 0.448 . . . . 25.0 110.09 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -76.14 2.53 12.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.385 -0.37 . . . . 25.0 111.488 174.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 58.1 22.78 9.37 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.353 1.461 . . . . 25.0 113.093 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -85.83 -21.86 27.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.148 -1.427 . . . . 25.0 107.148 173.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -123.89 159.08 30.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.9 p -136.72 175.96 9.14 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.881 -0.414 . . . . 25.0 109.881 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 72.62 5.22 5.19 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.523 1.675 . . . . 25.0 115.523 173.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -67.77 -36.51 80.62 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.671 -0.643 . . . . 25.0 111.282 173.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -63.25 1.67 Allowed Glycine 0 C--O 1.218 -0.858 0 O-C-N 123.552 0.532 . . . . 25.0 112.241 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -88.09 -53.86 4.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.5 1.143 . . . . 25.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.75 -7.15 7.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.401 -171.947 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.73 3.16 51.82 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.844 -0.535 . . . . 25.0 111.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -119.77 -33.99 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.272 -0.571 . . . . 25.0 110.911 173.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.98 107.46 22.07 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 107.746 -1.205 . . . . 25.0 107.746 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.485 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.7 Cg_endo -73.05 -19.23 23.24 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 116.276 -2.016 . . . . 25.0 114.389 -175.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -85.92 9.37 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.356 0.502 . . . . 25.0 112.356 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -61.4 -18.29 58.15 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.814 0.672 . . . . 25.0 112.814 178.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.4 m -65.29 124.21 19.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 114.721 1.378 . . . . 25.0 114.721 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -152.97 158.8 42.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.303 -1.74 . . . . 25.0 106.303 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.84 -166.57 18.99 Favored Glycine 0 N--CA 1.453 -0.172 0 N-CA-C 107.395 -2.282 . . . . 25.0 107.395 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.79 149.52 43.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 118.487 1.144 . . . . 25.0 112.31 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -67.03 156.93 34.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 107.126 -1.435 . . . . 25.0 107.126 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.18 -5.41 1.9 Allowed Glycine 0 C--N 1.318 -0.457 0 CA-C-N 114.953 -1.022 . . . . 25.0 112.394 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -75.97 145.85 78.15 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.25 -1.018 . . . . 25.0 108.25 -178.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -90.08 -19.99 13.05 Favored 'Cis proline' 0 CA--C 1.542 0.883 0 N-CA-C 115.859 1.446 . . . . 25.0 115.859 -4.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -71.08 -35.61 71.93 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.576 1.324 . . . . 25.0 114.576 -169.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.69 35.98 4.19 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.64 -1.985 . . . . 25.0 105.64 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -85.45 175.69 49.51 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.735 -1.121 . . . . 25.0 110.941 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.39 172.93 3.81 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 123.134 2.556 . . . . 25.0 113.616 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.0 30.99 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.203 -1.777 . . . . 25.0 106.203 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.71 139.56 57.83 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.504 -1.225 . . . . 25.0 107.725 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 -4.98 84.88 Favored Glycine 0 C--O 1.227 -0.316 0 C-N-CA 121.279 -0.486 . . . . 25.0 113.125 -174.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 55.1 m170 -124.82 10.28 8.3 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.349 -0.5 . . . . 25.0 109.816 177.196 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.1 mt -66.25 -45.27 90.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.31 -0.244 . . . . 25.0 110.903 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.44 -27.61 60.68 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.546 -0.539 . . . . 25.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.3 p -79.93 -7.66 58.89 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.459 0.911 . . . . 25.0 113.459 -176.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 35.53 18.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.582 0.753 . . . . 25.0 110.294 -173.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.8 OUTLIER 62.42 30.34 17.29 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.646 1.35 . . . . 25.0 114.646 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -117.51 137.33 52.62 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.828 -0.545 . . . . 25.0 111.992 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.99 -35.89 81.73 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 115.585 1.698 . . . . 25.0 115.585 -173.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.3 t -71.31 -4.87 28.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.522 0.564 . . . . 25.0 112.522 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.708 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.0 m-85 -123.39 11.9 9.36 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -73.57 -34.79 65.31 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.152 -0.968 . . . . 25.0 109.813 -176.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -71.61 -14.06 61.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.871 0.843 . . . . 25.0 109.419 175.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.708 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -90.46 -2.26 57.93 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.43 -32.19 6.0 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.312 0.577 . . . . 25.0 110.969 173.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.8 115.03 24.97 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 121.773 -0.579 . . . . 25.0 110.193 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -127.62 160.92 30.13 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.129 0.49 . . . . 25.0 110.027 176.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 33.0 p -119.87 162.45 33.03 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 100.384 -3.932 . . . . 25.0 100.384 162.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -70.12 -3.44 12.26 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 116.32 -1.987 . . . . 25.0 115.853 -175.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -122.37 7.74 9.62 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.656 0.741 . . . . 25.0 111.529 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -76.87 -28.54 55.45 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.345 -0.847 . . . . 25.0 113.204 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.481 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.3 m95 -126.92 167.23 16.14 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.741 0.305 . . . . 25.0 111.337 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -67.77 119.92 13.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.944 -1.873 . . . . 25.0 105.944 169.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.7 mmtt -95.43 105.24 17.19 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 100.507 -3.886 . . . . 25.0 100.507 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 135.32 54.6 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.664 -1.153 . . . . 25.0 110.291 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -92.0 101.73 14.28 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.173 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.6 mt -130.23 173.94 10.29 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.207 -1.034 . . . . 25.0 108.207 -175.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.85 157.33 22.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.364 -0.835 . . . . 25.0 111.224 -175.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 68.5 p -77.36 167.82 21.06 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.854 -1.535 . . . . 25.0 106.854 173.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.75 -161.87 23.97 Favored Glycine 0 C--O 1.241 0.543 0 N-CA-C 110.856 -0.897 . . . . 25.0 110.856 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.93 133.57 54.48 Favored 'Trans proline' 0 C--N 1.345 0.346 0 CA-C-N 118.989 1.394 . . . . 25.0 114.289 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -140.46 160.26 40.38 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.168 -1.79 . . . . 25.0 106.168 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 p -104.41 152.36 22.4 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 178.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -138.34 100.99 4.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 105.618 -1.993 . . . . 25.0 105.618 -178.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.86 119.21 38.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.876 0.846 . . . . 25.0 109.006 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.6 m95 -104.63 148.0 27.02 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.031 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -127.75 107.71 10.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.97 125.09 50.87 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 123.958 0.903 . . . . 25.0 112.187 -175.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -80.46 -20.22 44.27 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.297 -1.001 . . . . 25.0 108.297 168.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.85 108.62 16.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.85 -0.614 . . . . 25.0 111.586 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -77.63 0.57 22.72 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.869 1.433 . . . . 25.0 114.869 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 154.33 42.15 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.057 0.389 . . . . 25.0 110.21 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.5 t -70.57 155.91 40.11 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -171.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.2 t -97.78 159.37 14.97 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.281 -1.007 . . . . 25.0 108.281 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.5 t -117.77 -16.19 10.02 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 123.145 0.278 . . . . 25.0 111.322 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.5 t -172.13 153.24 3.05 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.991 0.424 . . . . 25.0 112.112 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.88 138.29 53.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 103.837 -2.653 . . . . 25.0 103.837 167.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -142.64 147.24 35.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -135.35 133.47 38.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -147.26 163.22 37.09 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.303 -0.628 . . . . 25.0 109.303 178.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.04 164.93 32.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 114.465 1.283 . . . . 25.0 114.465 -167.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.08 158.28 26.47 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 106.934 -1.506 . . . . 25.0 106.934 168.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -63.14 158.72 53.49 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.241 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.89 -20.55 38.92 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 116.681 -1.746 . . . . 25.0 114.252 -174.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -120.55 32.05 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.552 0.575 . . . . 25.0 112.552 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.499 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -71.89 165.51 24.0 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.932 0.873 . . . . 25.0 111.558 -179.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.04 101.01 10.84 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.725 -1.125 . . . . 25.0 109.706 -179.077 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.499 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.16 15.21 6.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.636 2.087 . . . . 25.0 116.636 -169.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.4 t -124.17 9.24 8.61 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -113.16 156.63 42.69 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 107.465 -1.309 . . . . 25.0 107.465 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.57 156.31 66.19 Favored 'Trans proline' 0 C--N 1.345 0.343 0 O-C-N 121.918 0.431 . . . . 25.0 112.016 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.52 104.24 3.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.187 0.517 . . . . 25.0 111.395 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.3 p -92.61 159.56 15.42 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -65.69 -25.97 67.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.159 0.504 . . . . 25.0 110.719 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.58 -22.48 60.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.481 -0.782 . . . . 25.0 112.745 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 21.2 m -77.39 -12.11 59.92 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.07 0.396 . . . . 25.0 112.07 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -99.77 158.35 15.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 114.555 1.317 . . . . 25.0 114.555 -175.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -96.02 98.23 10.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 102.38 -3.193 . . . . 25.0 102.38 161.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 74.8 mt -66.86 -7.62 23.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 115.003 1.483 . . . . 25.0 115.003 -169.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -83.8 131.37 52.1 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 108.706 -0.85 . . . . 25.0 108.706 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -72.54 150.44 51.38 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 115.15 -2.767 . . . . 25.0 111.047 177.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -102.25 -11.85 18.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.399 . . . . 25.0 111.603 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 64.0 m -149.84 66.87 0.99 Allowed 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 116.234 -0.439 . . . . 25.0 110.742 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -89.06 133.47 34.34 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.078 -1.049 . . . . 25.0 109.01 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -123.78 99.07 6.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 104.833 -2.284 . . . . 25.0 104.833 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.9 92.11 8.19 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.129 -1.434 . . . . 25.0 107.129 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -105.98 118.2 36.0 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.065 -1.457 . . . . 25.0 107.065 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.99 82.45 0.37 Allowed Glycine 0 CA--C 1.501 -0.826 0 CA-C-N 115.476 -0.784 . . . . 25.0 112.609 -170.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.4 13.99 6.06 Favored Glycine 0 C--N 1.32 -0.332 0 C-N-CA 120.998 -0.62 . . . . 25.0 113.357 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.49 104.0 5.04 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.514 0.673 . . . . 25.0 109.542 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 83.6 mt -73.57 124.5 90.42 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 106.367 -1.716 . . . . 25.0 106.367 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.47 158.74 53.28 Favored 'Trans proline' 0 C--N 1.345 0.384 0 N-CA-C 113.645 0.594 . . . . 25.0 113.645 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.48 28.66 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.81 -17.92 0.33 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.962 1.705 . . . . 25.0 111.508 -173.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' A' ' 128' ' ' ALA . 50.2 mt-30 -127.68 150.8 49.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 104.668 -2.345 . . . . 25.0 104.668 169.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 46.0 t -141.02 95.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 106.764 -1.569 . . . . 25.0 106.764 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.9 t -89.65 126.88 35.8 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 107.509 -1.293 . . . . 25.0 107.509 175.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.11 166.86 20.16 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 105.443 -2.058 . . . . 25.0 105.443 177.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -136.01 152.7 51.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 104.825 -2.287 . . . . 25.0 104.825 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.69 159.35 30.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.525 -0.917 . . . . 25.0 108.525 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -103.8 115.69 30.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.391 -0.368 . . . . 25.0 110.902 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.01 131.57 72.74 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 107.891 -1.151 . . . . 25.0 107.891 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.94 147.11 95.85 Favored 'Trans proline' 0 C--N 1.354 0.861 0 CA-C-O 121.642 0.601 . . . . 25.0 113.504 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.61 -26.77 37.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.132 -0.94 . . . . 25.0 112.745 -168.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -82.67 8.45 11.99 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.565 0.698 . . . . 25.0 110.321 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -114.5 51.87 0.87 Allowed 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.816 0.817 . . . . 25.0 109.144 173.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.7 p -85.98 163.33 18.05 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 93.6 -169.28 29.95 Favored Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 115.243 0.857 . . . . 25.0 115.243 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.05 108.33 18.21 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.358 0.599 . . . . 25.0 110.86 -168.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' HIS . . . . . 0.415 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 43.1 p-80 -157.39 169.44 24.72 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.86 -0.609 . . . . 25.0 112.015 -176.07 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.3 148.16 10.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 N-CA-C 108.427 -0.953 . . . . 25.0 108.427 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 65.7 mt -131.03 121.21 49.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 104.776 -2.305 . . . . 25.0 104.776 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.14 130.52 53.3 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.32 -0.855 . . . . 25.0 109.963 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.16 123.9 46.65 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.043 -0.725 . . . . 25.0 109.043 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.9 p -114.11 137.78 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.952 0.882 . . . . 25.0 111.653 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -112.09 118.99 36.92 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.933 -1.506 . . . . 25.0 106.933 176.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.71 126.45 45.75 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.745 -0.835 . . . . 25.0 108.745 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.3 mm -80.84 143.05 12.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 109.071 -0.714 . . . . 25.0 109.071 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.98 -45.98 17.47 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.724 0.693 . . . . 25.0 110.212 175.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -68.13 -22.55 64.87 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.45 1.278 . . . . 25.0 114.45 -172.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -137.45 168.52 19.48 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.965 0.888 . . . . 25.0 110.084 -174.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.41 21.4 0.62 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.097 -0.956 . . . . 25.0 112.533 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -93.62 146.34 23.89 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.024 0.75 . . . . 25.0 113.024 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.34 143.62 15.18 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.088 -2.19 . . . . 25.0 105.088 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -148.51 136.05 20.53 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.958 0.725 . . . . 25.0 112.958 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -92.0 113.99 26.42 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.199 0.599 . . . . 25.0 111.598 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.1 108.67 21.45 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.056 -0.72 . . . . 25.0 109.056 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.24 142.19 30.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.596 -0.729 . . . . 25.0 112.198 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.5 136.37 61.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.264 -2.125 . . . . 25.0 105.264 166.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -97.73 130.35 44.7 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 176.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.56 162.8 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 112.74 0.645 . . . . 25.0 112.74 -174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -118.25 95.04 4.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 104.348 -2.464 . . . . 25.0 104.348 167.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -89.99 163.72 14.82 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 112.242 0.46 . . . . 25.0 112.242 -171.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.6 p -143.42 154.96 44.24 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 176.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.135 -0.936 . . . . 25.0 111.086 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 48.6 m-70 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.891 0.377 . . . . 25.0 110.658 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.55 165.89 20.37 Favored Glycine 0 C--O 1.229 -0.167 1 N-CA-C 102.362 -4.295 . . . . 25.0 102.362 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -148.04 163.55 36.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 120.561 2.181 . . . . 25.0 111.916 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -100.2 123.36 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -77.8 -42.61 33.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.604 -1.18 . . . . 25.0 110.265 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -152.45 129.23 5.5 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.91 131.55 11.4 Favored 'Cis proline' 0 C--N 1.348 0.502 0 CA-C-N 118.83 0.618 . . . . 25.0 111.118 -0.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 109.87 2.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.931 -0.577 . . . . 25.0 112.15 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 t -72.03 157.55 37.59 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -56.09 -24.3 39.41 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.337 0.655 . . . . 25.0 111.985 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.12 -53.69 41.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.803 0.811 . . . . 25.0 109.262 175.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -67.11 -36.42 81.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 25.0 110.463 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -61.92 -32.55 72.96 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 121.106 -0.237 . . . . 25.0 111.028 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -40.84 97.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.306 0.574 . . . . 25.0 110.519 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.472 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.77 -33.04 70.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.066 0.46 . . . . 25.0 110.031 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.1 mt -76.12 5.4 6.83 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.425 -0.352 . . . . 25.0 111.777 175.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 62.9 14.82 7.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.621 1.168 . . . . 25.0 113.352 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -84.06 -22.55 31.18 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.719 -0.845 . . . . 25.0 108.719 176.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -124.46 158.91 31.7 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 104.792 -2.299 . . . . 25.0 104.792 176.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.9 p -137.65 174.01 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.081 -0.341 . . . . 25.0 110.081 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 70.25 5.02 5.13 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 116.681 2.104 . . . . 25.0 116.681 176.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.7 m -64.57 -32.33 73.94 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 121.916 -0.49 . . . . 25.0 110.388 172.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 -63.08 1.79 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.818 0.699 . . . . 25.0 112.023 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.6 t -88.06 -53.48 4.7 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.611 1.196 . . . . 25.0 111.587 -178.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.6 t -68.1 -12.72 16.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.376 -1.284 . . . . 25.0 112.931 -171.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -84.69 -0.82 54.89 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 121.852 -0.53 . . . . 25.0 111.865 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -117.56 -34.16 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.047 -0.661 . . . . 25.0 110.376 172.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.04 104.67 22.63 Favored Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 109.531 -0.544 . . . . 25.0 109.531 171.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.472 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.6 Cg_endo -74.89 -19.78 17.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 116.758 -1.695 . . . . 25.0 113.963 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -86.37 12.85 9.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.934 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -66.48 -14.0 61.62 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.754 0.312 . . . . 25.0 111.613 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 19.4 m -64.02 129.23 27.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 113.839 1.051 . . . . 25.0 113.839 -177.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -152.93 152.4 31.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.383 -1.34 . . . . 25.0 107.383 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.86 -172.96 27.74 Favored Glycine 0 N--CA 1.455 -0.094 0 N-CA-C 108.843 -1.703 . . . . 25.0 108.843 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.0 148.27 47.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 118.426 1.113 . . . . 25.0 111.827 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.14 156.92 32.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.12 -1.437 . . . . 25.0 107.12 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.42 2.13 2.99 Favored Glycine 0 C--N 1.318 -0.45 0 CA-C-N 114.929 -1.032 . . . . 25.0 112.919 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -75.91 141.39 71.52 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -93.0 -13.46 20.96 Favored 'Cis proline' 0 CA--C 1.543 0.948 0 C-N-CA 130.474 1.447 . . . . 25.0 115.469 -6.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.88 -37.07 75.93 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.483 1.29 . . . . 25.0 114.483 -169.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.01 30.91 6.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.251 -2.129 . . . . 25.0 105.251 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.98 179.05 43.92 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.899 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -62.6 173.0 3.91 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.743 2.295 . . . . 25.0 113.628 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.01 30.99 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -60.54 140.02 57.52 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 107.001 -1.481 . . . . 25.0 107.001 174.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.03 -5.01 78.42 Favored Glycine 0 N--CA 1.459 0.176 0 CA-C-O 121.817 0.676 . . . . 25.0 112.583 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -126.03 8.4 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.998 -0.741 . . . . 25.0 108.998 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.94 -52.76 49.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 122.308 -0.245 . . . . 25.0 111.637 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.57 -21.11 59.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.372 -0.603 . . . . 25.0 109.372 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.0 p -81.86 -7.62 59.62 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.597 0.592 . . . . 25.0 112.597 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.29 31.19 11.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.512 0.725 . . . . 25.0 110.33 -173.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.57 36.58 25.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.715 1.376 . . . . 25.0 114.715 -176.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -120.73 136.29 54.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.992 0.517 . . . . 25.0 110.585 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.08 -33.89 75.27 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 115.234 1.568 . . . . 25.0 115.234 -174.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 55' ' ' THR . 1.5 t -71.12 -7.15 44.62 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.622 0.601 . . . . 25.0 112.622 -178.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.67 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.7 m-85 -120.84 13.09 11.43 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -71.37 -37.23 71.64 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.243 -0.91 . . . . 25.0 111.338 -176.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -69.82 -17.98 63.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.294 1.045 . . . . 25.0 108.757 177.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.67 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -85.51 -8.19 58.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.081 -0.963 . . . . 25.0 109.174 -177.384 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -113.12 -36.13 5.16 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.671 1.36 . . . . 25.0 114.671 176.144 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -104.92 125.94 51.46 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.102 -0.999 . . . . 25.0 110.821 -176.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.5 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.4 pm0 -127.73 161.05 29.84 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.286 -1.325 . . . . 25.0 110.029 -176.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -112.6 162.66 20.54 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 100.663 -3.829 . . . . 25.0 100.663 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -70.45 -0.14 7.04 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 N-CA-C 116.129 1.55 . . . . 25.0 116.129 -174.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -127.92 13.64 6.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.587 0.708 . . . . 25.0 110.251 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -30.48 45.19 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.825 1.046 . . . . 25.0 113.825 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.5 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 15.8 m95 -126.77 167.89 15.16 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.599 -0.519 . . . . 25.0 109.599 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -66.46 126.89 30.27 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.246 -1.761 . . . . 25.0 106.246 171.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -98.97 106.19 18.42 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 100.543 -3.873 . . . . 25.0 100.543 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.63 134.66 52.77 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.06 -0.973 . . . . 25.0 110.259 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -91.69 100.66 13.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.691 -1.14 . . . . 25.0 108.021 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.5 mt -131.89 173.96 10.65 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.135 -1.061 . . . . 25.0 108.135 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.78 156.38 23.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.944 -176.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 139' ' ' ALA . 53.3 p -77.13 167.9 20.99 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.163 -1.421 . . . . 25.0 107.163 172.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.26 -160.78 23.04 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 110.518 -1.033 . . . . 25.0 110.518 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.87 132.98 50.81 Favored 'Trans proline' 0 C--N 1.345 0.387 0 CA-C-N 119.202 1.501 . . . . 25.0 114.079 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.31 161.98 36.39 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.7 p -101.52 150.86 22.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.829 -1.175 . . . . 25.0 107.829 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -137.66 100.96 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.98 121.46 45.41 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 123.923 0.889 . . . . 25.0 109.52 -177.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -107.36 152.18 24.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.035 -0.984 . . . . 25.0 110.161 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -129.35 114.54 16.33 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 104.789 -2.3 . . . . 25.0 104.789 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.8 mp -115.05 117.87 31.8 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.193 -173.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -81.91 6.58 15.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.302 0.572 . . . . 25.0 111.272 173.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -122.62 132.32 54.23 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.979 -0.451 . . . . 25.0 110.345 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -80.63 -9.63 59.78 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.874 0.694 . . . . 25.0 112.874 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.15 155.58 31.16 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.19 0.441 . . . . 25.0 112.19 -176.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 t -76.99 155.89 32.3 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.819 0.818 . . . . 25.0 112.859 -175.179 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.463 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 6.6 t -97.92 158.24 15.64 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.502 -1.296 . . . . 25.0 107.502 173.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -117.92 -15.6 9.98 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.102 0.251 . . . . 25.0 111.195 172.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -171.99 150.25 2.52 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.312 0.486 . . . . 25.0 112.312 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -123.94 138.54 54.45 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.457 -2.423 . . . . 25.0 104.457 167.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.6 mtt-85 -137.27 144.76 42.87 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -137.94 127.52 25.05 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.686 -1.598 . . . . 25.0 106.686 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -147.74 168.76 21.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.675 -0.861 . . . . 25.0 108.675 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.51 167.38 26.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 113.394 0.887 . . . . 25.0 113.394 -168.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.3 p -79.06 160.53 27.07 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.735 . . . . 25.0 106.317 167.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -62.13 159.0 41.66 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.708 -0.678 . . . . 25.0 109.553 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.26 -24.53 37.6 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 116.923 -1.584 . . . . 25.0 113.056 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -115.02 32.06 6.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.092 0.557 . . . . 25.0 110.762 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -72.68 165.42 24.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.135 0.969 . . . . 25.0 113.577 -174.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -83.17 101.04 10.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.377 -1.283 . . . . 25.0 110.293 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.93 7.99 28.34 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 117.715 2.487 . . . . 25.0 117.715 -168.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.0 t -123.44 8.32 9.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.778 0.799 . . . . 25.0 109.231 176.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -107.25 160.52 26.18 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 114.541 -1.209 . . . . 25.0 108.916 -172.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -64.53 152.51 81.42 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 118.051 -0.833 . . . . 25.0 111.412 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -71.59 100.14 2.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.498 0.666 . . . . 25.0 110.868 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -88.96 153.97 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.503 -1.295 . . . . 25.0 107.503 176.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.21 -25.93 68.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.257 0.551 . . . . 25.0 111.167 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.47 61.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.333 -0.849 . . . . 25.0 112.801 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.4 t -79.29 -3.93 48.36 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.196 0.443 . . . . 25.0 112.196 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -106.01 155.58 19.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -96.47 91.24 5.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 101.952 -3.351 . . . . 25.0 101.952 161.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.82 -7.11 37.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -171.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.39 119.6 77.79 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.862 -1.162 . . . . 25.0 107.862 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -72.09 143.27 39.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 114.998 -2.868 . . . . 25.0 112.416 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -95.0 -14.59 24.22 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.064 0.394 . . . . 25.0 112.064 -176.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 75.1 m -147.94 62.77 1.12 Allowed 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.827 0.306 . . . . 25.0 111.827 178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -88.96 139.46 30.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 118.24 -1.384 . . . . 25.0 108.705 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -124.92 99.12 5.99 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -92.47 92.12 7.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.016 -1.476 . . . . 25.0 107.016 -176.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -106.15 117.9 35.24 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.438 -0.949 . . . . 25.0 108.438 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -96.92 77.88 0.69 Allowed Glycine 0 CA--C 1.504 -0.628 0 CA-C-N 115.45 -0.795 . . . . 25.0 114.023 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.93 20.39 5.3 Favored Glycine 0 C--N 1.321 -0.275 0 C-N-CA 120.882 -0.675 . . . . 25.0 113.862 178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.38 105.13 5.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.497 0.665 . . . . 25.0 109.828 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.24 125.99 91.24 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 105.563 -2.014 . . . . 25.0 105.563 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.5 169.14 23.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 118.369 -0.621 . . . . 25.0 113.598 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.22 31.49 4.26 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.372 -1.344 . . . . 25.0 107.372 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.66 -17.94 0.27 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.94 1.696 . . . . 25.0 112.132 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.9 mt-30 -129.25 155.47 45.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 104.703 -2.332 . . . . 25.0 104.703 171.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.1 t -140.72 95.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.417 -2.068 . . . . 25.0 105.417 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.9 t -95.52 142.58 27.7 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -156.95 167.03 31.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 113.709 -1.587 . . . . 25.0 108.628 -175.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -129.77 156.89 43.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.88 -1.526 . . . . 25.0 106.88 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.12 161.35 31.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.483 -1.302 . . . . 25.0 107.483 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -105.09 117.16 33.3 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.085 0.241 . . . . 25.0 111.101 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.54 132.25 69.48 Favored Pre-proline 0 CA--C 1.541 0.628 0 N-CA-C 107.888 -1.152 . . . . 25.0 107.888 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -61.26 145.75 98.14 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-O 121.705 0.627 . . . . 25.0 113.472 -179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.429 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.62 -25.64 35.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.178 -0.919 . . . . 25.0 112.665 -168.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -84.24 9.77 12.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.611 0.719 . . . . 25.0 110.212 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -115.18 53.55 0.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.345 -0.983 . . . . 25.0 108.345 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.9 p -86.12 165.45 16.59 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 106.748 -1.575 . . . . 25.0 106.748 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.14 -167.08 32.68 Favored Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 115.368 0.907 . . . . 25.0 115.368 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.7 t -86.0 108.13 18.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.959 0.409 . . . . 25.0 110.799 -168.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 38.5 p-80 -158.53 168.39 27.04 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 113.816 1.043 . . . . 25.0 113.816 -174.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 16.1 t -100.91 146.24 9.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.376 -0.972 . . . . 25.0 108.376 -179.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.81 129.65 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 102.114 -3.291 . . . . 25.0 102.114 179.08 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.44 132.57 54.98 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.522 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -113.09 111.88 22.88 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -106.31 142.19 19.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.356 0.598 . . . . 25.0 110.087 -176.402 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.463 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 18.2 t90 -123.63 124.31 42.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.0 -1.0 . . . . 25.0 108.608 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -105.21 129.46 53.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.998 -0.742 . . . . 25.0 108.998 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.2 mm -85.97 141.11 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.313 -0.625 . . . . 25.0 109.313 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.78 20.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.714 0.688 . . . . 25.0 110.528 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -23.33 64.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.077 1.14 . . . . 25.0 114.077 -171.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.5 p -138.39 169.9 16.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 122.046 0.926 . . . . 25.0 110.32 -174.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.97 19.05 0.73 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.999 -1.0 . . . . 25.0 112.325 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -90.3 147.62 23.38 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.66 -0.65 . . . . 25.0 112.528 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.05 144.67 19.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 104.414 -2.439 . . . . 25.0 104.414 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -143.43 147.94 35.37 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.721 0.237 . . . . 25.0 110.51 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -109.4 107.76 18.04 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.856 0.863 . . . . 25.0 109.666 -174.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.13 20.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.189 0.519 . . . . 25.0 110.142 -177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.56 145.93 26.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.953 -0.567 . . . . 25.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.87 147.09 32.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 103.782 -2.673 . . . . 25.0 103.782 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -110.75 130.64 55.52 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.241 -1.762 . . . . 25.0 106.241 176.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.0 m -132.76 162.45 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.738 0.644 . . . . 25.0 112.738 -173.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -117.98 95.12 4.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 104.336 -2.468 . . . . 25.0 104.336 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.89 163.99 13.83 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 112.919 0.711 . . . . 25.0 112.919 -171.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.4 p -144.74 164.43 31.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.977 -1.12 . . . . 25.0 107.977 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.839 0 CA-C-O 117.592 -1.194 . . . . 25.0 111.959 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.1 m170 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.332 -0.248 . . . . 25.0 110.332 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.33 165.14 33.04 Favored Glycine 0 CA--C 1.509 -0.284 1 N-CA-C 102.887 -4.085 . . . . 25.0 102.887 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -145.78 158.4 43.86 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 119.668 1.734 . . . . 25.0 110.984 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.15 119.56 34.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.72 -43.15 48.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.279 -1.328 . . . . 25.0 109.319 -174.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.8 t -155.37 128.38 4.26 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -63.9 128.52 7.13 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 C-N-CA 129.706 1.128 . . . . 25.0 112.346 0.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.75 116.83 8.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.777 0.658 . . . . 25.0 112.777 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.4 t -72.11 157.84 37.02 Favored 'General case' 0 C--O 1.216 -0.665 0 N-CA-C 109.011 -0.737 . . . . 25.0 109.011 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.93 -25.12 41.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.602 0.761 . . . . 25.0 111.656 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -52.76 44.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.755 0.788 . . . . 25.0 109.155 175.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.94 -36.72 84.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 25.0 110.308 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -63.65 -33.74 76.29 Favored 'General case' 0 C--O 1.219 -0.531 0 O-C-N 122.223 -0.298 . . . . 25.0 110.899 178.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -40.26 96.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.342 0.591 . . . . 25.0 109.915 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.423 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 6.3 tmtm? -68.45 -33.85 74.92 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.212 0.529 . . . . 25.0 110.311 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.5 mt -79.08 5.14 12.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 25.0 111.276 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 58.7 24.77 12.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.177 1.391 . . . . 25.0 112.909 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -89.7 -21.44 22.72 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.914 -1.143 . . . . 25.0 107.914 174.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -123.51 160.28 27.3 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 105.669 -1.974 . . . . 25.0 105.669 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 42.6 p -134.31 175.13 9.78 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 122.449 0.3 . . . . 25.0 110.456 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 69.39 5.23 5.03 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.877 1.806 . . . . 25.0 115.877 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -66.67 -38.52 86.99 Favored 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 121.344 -0.848 . . . . 25.0 111.145 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -63.33 1.54 Allowed Glycine 0 C--O 1.218 -0.9 0 O-C-N 123.55 0.531 . . . . 25.0 112.449 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -53.73 4.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.549 1.166 . . . . 25.0 111.806 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -7.03 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.603 -1.18 . . . . 25.0 113.63 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.419 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.6 pt20 -88.27 2.0 53.32 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.8 -0.563 . . . . 25.0 111.102 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -117.65 -34.05 4.36 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.742 -0.383 . . . . 25.0 110.791 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -126.93 107.62 22.2 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 172.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.423 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 84.1 Cg_endo -76.9 -18.55 14.71 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 116.867 -1.622 . . . . 25.0 113.797 -171.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -90.66 12.01 20.34 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.64 0.607 . . . . 25.0 112.64 -177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.0 m -62.18 -17.93 59.5 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.092 0.472 . . . . 25.0 112.121 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.418 ' H ' HG22 ' A' ' 32' ' ' VAL . 2.2 m -64.1 120.65 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.81 0.814 . . . . 25.0 112.695 -179.301 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -152.99 156.5 38.96 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.56 -169.05 24.34 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -176.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.7 tp -118.18 147.77 43.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.216 1.008 . . . . 25.0 111.917 -176.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.46 156.88 31.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 172.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 139.95 1.69 1.76 Allowed Glycine 0 C--O 1.223 -0.536 0 CA-C-N 114.768 -1.105 . . . . 25.0 113.195 179.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -75.99 139.07 69.07 Favored Pre-proline 0 C--N 1.321 -0.655 0 O-C-N 121.569 -0.959 . . . . 25.0 109.631 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.2 -13.13 21.23 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 C-N-CA 130.438 1.433 . . . . 25.0 115.509 -6.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -71.63 -36.76 70.86 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -168.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.69 31.95 5.74 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.26 -174.42 42.05 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.336 -1.302 . . . . 25.0 110.859 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -61.96 170.26 6.33 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.446 2.097 . . . . 25.0 113.097 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 159.97 31.12 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 106.592 -1.633 . . . . 25.0 106.592 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.62 138.84 58.01 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.563 -1.199 . . . . 25.0 108.34 177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.36 -4.12 82.46 Favored Glycine 0 C--O 1.227 -0.296 0 C-N-CA 121.216 -0.516 . . . . 25.0 112.844 -174.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -124.45 9.08 8.42 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.656 -0.868 . . . . 25.0 108.656 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.79 -47.27 86.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 O-C-N 122.405 -0.185 . . . . 25.0 110.906 -172.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.02 -18.46 58.13 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.024 -0.423 . . . . 25.0 110.182 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 p -87.97 -7.17 57.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.41 32.81 11.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.659 0.784 . . . . 25.0 110.412 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.96 37.08 24.69 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -177.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -120.7 137.28 54.55 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.124 0.569 . . . . 25.0 111.11 175.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.7 p -62.62 -35.43 79.54 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.378 1.621 . . . . 25.0 115.378 -174.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -71.56 -6.97 44.68 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.615 0.598 . . . . 25.0 112.615 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.684 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.6 m-85 -120.44 11.91 11.51 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 107.32 -1.363 . . . . 25.0 107.32 -179.433 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.62 -34.47 67.35 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.051 -1.031 . . . . 25.0 110.084 -175.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -71.27 -15.56 62.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.947 0.879 . . . . 25.0 109.945 174.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.684 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.91 -6.48 58.04 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 -177.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.55 -32.36 6.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.097 0.475 . . . . 25.0 111.81 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -98.15 121.91 40.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 121.743 -0.598 . . . . 25.0 110.052 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -129.68 160.97 31.69 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.022 -0.733 . . . . 25.0 109.022 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.7 p -115.79 162.39 25.64 Favored Pre-proline 0 C--N 1.321 -0.666 1 N-CA-C 100.108 -4.034 . . . . 25.0 100.108 162.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.9 -4.9 14.34 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 116.744 -1.704 . . . . 25.0 115.586 -175.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -125.15 10.7 8.13 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.079 0.466 . . . . 25.0 111.783 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -77.72 -30.14 51.59 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.657 -0.652 . . . . 25.0 112.593 -176.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 10.4 m95 -125.07 164.7 19.63 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.85 -0.426 . . . . 25.0 109.85 -178.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -66.83 129.15 38.95 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 171.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -100.9 105.54 16.81 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 100.694 -3.817 . . . . 25.0 100.694 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.9 mp -68.54 136.31 52.92 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.12 -0.946 . . . . 25.0 110.784 -176.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -88.26 111.92 22.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.915 -1.039 . . . . 25.0 108.856 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.1 mt -137.09 173.19 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.143 -1.058 . . . . 25.0 108.143 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.22 156.3 25.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.704 -0.68 . . . . 25.0 110.467 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.442 HG21 ' HA ' ' A' ' 139' ' ' ALA . 70.5 p -76.95 170.47 16.45 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 173.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 92.44 -161.87 26.54 Favored Glycine 0 C--O 1.239 0.456 0 CA-C-O 118.95 -0.917 . . . . 25.0 110.95 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -58.94 131.2 40.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 CA-C-N 119.149 1.475 . . . . 25.0 113.517 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -139.26 163.11 33.33 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.093 -1.447 . . . . 25.0 107.093 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.8 p -104.17 152.45 22.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.03 -1.1 . . . . 25.0 108.03 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -140.62 101.09 4.01 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 104.917 -2.253 . . . . 25.0 104.917 -177.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.98 134.98 49.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -120.35 153.21 36.79 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.962 -1.472 . . . . 25.0 109.542 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -130.44 117.25 19.39 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 104.21 -2.515 . . . . 25.0 104.21 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.9 137.64 52.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.139 -0.937 . . . . 25.0 111.22 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.8 t -92.75 2.36 56.78 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.984 0.421 . . . . 25.0 111.219 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -128.57 139.46 52.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.932 0.396 . . . . 25.0 111.142 -177.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.3 mmm-85 -92.06 1.77 56.99 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.895 -0.593 . . . . 25.0 112.49 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.25 148.81 49.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.591 -0.444 . . . . 25.0 110.083 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.4 t -71.8 155.93 39.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.078 1.14 . . . . 25.0 114.078 -170.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.448 HG21 ' HE1' ' A' ' 92' ' ' TRP . 14.8 t -99.03 159.45 14.95 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.179 -1.045 . . . . 25.0 108.179 173.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -117.96 -13.75 10.03 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.125 0.266 . . . . 25.0 110.589 170.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.62 151.87 2.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.803 0.335 . . . . 25.0 111.325 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.448 ' HE1' HG21 ' A' ' 89' ' ' THR . 63.1 m95 -122.72 141.51 51.71 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.274 -2.491 . . . . 25.0 104.274 165.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -145.34 152.98 40.74 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.727 -1.212 . . . . 25.0 107.727 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -136.71 134.81 37.58 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.786 -1.931 . . . . 25.0 105.786 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.59 165.23 31.0 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.196 0.453 . . . . 25.0 109.822 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.01 167.83 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 113.713 1.005 . . . . 25.0 113.713 -166.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.9 p -82.25 163.78 21.62 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.235 -1.024 . . . . 25.0 108.235 168.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.39 159.38 41.26 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.349 -0.842 . . . . 25.0 109.355 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.87 -24.23 34.2 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 116.063 -2.158 . . . . 25.0 113.581 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -115.58 31.87 6.43 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 122.915 0.486 . . . . 25.0 111.069 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' TRP . . . . . 0.495 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 7.0 p-90 -71.98 166.57 21.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.13 0.967 . . . . 25.0 112.524 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.06 101.04 10.87 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.51 -1.223 . . . . 25.0 109.212 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.495 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.11 15.13 10.76 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 116.041 1.867 . . . . 25.0 116.041 -169.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -128.1 13.2 6.71 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.701 -0.852 . . . . 25.0 108.701 176.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -117.54 157.24 48.11 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.521 -1.218 . . . . 25.0 107.976 -174.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -64.93 153.2 79.33 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 O-C-N 121.961 0.453 . . . . 25.0 111.798 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.63 103.77 4.34 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.58 0.705 . . . . 25.0 112.308 -175.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 19.9 p -98.02 161.41 13.74 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.157 -0.683 . . . . 25.0 109.157 177.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -68.03 -23.39 64.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.234 0.54 . . . . 25.0 111.029 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.69 63.4 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.212 -0.904 . . . . 25.0 112.034 176.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.3 m -85.65 -9.73 56.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.115 0.483 . . . . 25.0 111.415 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -95.54 154.58 17.13 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 114.363 1.245 . . . . 25.0 114.363 -177.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -97.74 94.27 6.85 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 102.512 -3.144 . . . . 25.0 102.512 161.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.47 -7.51 20.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.569 1.322 . . . . 25.0 114.569 -170.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -81.79 132.47 54.43 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.061 -0.718 . . . . 25.0 109.061 177.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -72.66 150.92 51.54 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 115.01 -2.86 . . . . 25.0 110.615 176.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -102.32 -9.84 20.01 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.961 0.41 . . . . 25.0 111.17 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 47.7 m -151.86 70.82 0.95 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 25.0 109.793 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.08 135.14 33.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.06 -1.056 . . . . 25.0 108.964 176.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -121.22 99.1 6.3 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.168 -2.901 . . . . 25.0 103.168 177.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -90.32 91.93 8.7 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -113.68 118.44 34.36 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 107.763 -1.199 . . . . 25.0 107.763 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.32 83.71 0.38 Allowed Glycine 0 CA--C 1.5 -0.874 0 CA-C-N 115.311 -0.859 . . . . 25.0 112.564 -170.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.33 14.04 6.64 Favored Glycine 0 C--N 1.32 -0.313 0 C-N-CA 121.054 -0.593 . . . . 25.0 113.253 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.31 105.56 5.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.58 0.705 . . . . 25.0 109.334 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -74.39 121.62 85.64 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 107.039 -1.467 . . . . 25.0 107.039 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -72.32 162.89 40.28 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 118.267 -0.689 . . . . 25.0 112.933 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -100.14 27.58 5.51 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.665 -0.865 . . . . 25.0 108.665 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.03 -9.79 0.82 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.604 1.561 . . . . 25.0 111.676 -174.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -132.26 151.81 51.65 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 103.49 -2.782 . . . . 25.0 103.49 170.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 49.4 t -142.03 95.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.638 . . . . 25.0 106.576 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -90.99 138.36 31.67 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.49 164.93 30.97 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 106.287 -1.746 . . . . 25.0 106.287 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -136.46 149.01 48.01 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.962 -2.236 . . . . 25.0 104.962 174.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 160.94 31.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.328 -1.36 . . . . 25.0 107.328 -176.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -101.16 118.44 36.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.528 0.204 . . . . 25.0 111.368 -177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.3 mt -78.94 132.64 63.35 Favored Pre-proline 0 CA--C 1.541 0.625 0 N-CA-C 107.831 -1.174 . . . . 25.0 107.831 176.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -61.52 146.84 96.64 Favored 'Trans proline' 0 C--N 1.355 0.872 0 CA-C-O 121.611 0.588 . . . . 25.0 113.492 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.442 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.84 -26.83 33.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.162 -0.927 . . . . 25.0 112.56 -169.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -84.35 9.48 13.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.582 -0.736 . . . . 25.0 110.376 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -113.32 52.98 0.78 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.677 -0.86 . . . . 25.0 108.677 171.553 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.1 p -85.99 161.72 18.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.48 -165.41 31.14 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 115.562 0.985 . . . . 25.0 115.562 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.1 t -85.82 109.05 18.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.443 0.64 . . . . 25.0 111.267 -168.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.5 p-80 -158.31 171.51 20.04 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.777 -0.647 . . . . 25.0 110.379 -176.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.37 150.64 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.5 mt -132.99 129.29 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 N-CA-C 101.478 -3.527 . . . . 25.0 101.478 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 137.53 53.58 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.102 -0.499 . . . . 25.0 109.78 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -119.02 134.68 55.04 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 109.561 -0.533 . . . . 25.0 109.561 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -124.52 140.09 48.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.126 0.965 . . . . 25.0 111.762 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -111.44 109.7 19.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 113.495 -1.684 . . . . 25.0 106.675 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -91.08 121.5 32.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.431 -1.322 . . . . 25.0 107.431 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.2 mm -79.65 141.75 14.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.528 -0.545 . . . . 25.0 109.528 -178.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.33 -42.14 23.51 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.699 0.681 . . . . 25.0 110.163 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.0 -24.72 65.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.592 0.96 . . . . 25.0 113.592 -172.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 63.5 p -139.53 169.52 17.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.938 0.875 . . . . 25.0 110.084 -174.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.04 23.67 0.55 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.193 -0.912 . . . . 25.0 112.295 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -92.77 146.28 23.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.991 0.738 . . . . 25.0 112.991 -176.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.25 143.12 10.35 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.785 -1.932 . . . . 25.0 105.785 172.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -148.77 132.87 17.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 111.676 0.25 . . . . 25.0 111.676 178.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.12 114.9 26.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.414 0.446 . . . . 25.0 110.821 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -97.11 108.14 20.81 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.65 -0.87 . . . . 25.0 108.65 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.26 139.9 35.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.236 -0.893 . . . . 25.0 113.201 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -125.98 132.69 70.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.998 -1.853 . . . . 25.0 105.998 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -91.39 130.28 37.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.377 -1.342 . . . . 25.0 107.377 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.83 162.19 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.941 0.719 . . . . 25.0 112.941 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -119.95 95.64 4.85 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 104.47 -2.418 . . . . 25.0 104.47 168.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.41 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.03 163.23 14.99 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.483 0.549 . . . . 25.0 112.483 -172.232 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.2 p -143.36 156.31 44.65 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.944 -1.132 . . . . 25.0 107.944 176.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.013 -0.994 . . . . 25.0 111.466 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.8 m80 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.951 0.405 . . . . 25.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.89 177.27 33.86 Favored Glycine 0 CA--C 1.508 -0.352 1 N-CA-C 101.928 -4.469 . . . . 25.0 101.928 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -145.84 163.95 33.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 119.973 1.886 . . . . 25.0 109.689 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -100.74 122.01 52.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 106.497 -1.668 . . . . 25.0 106.497 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.23 -42.37 59.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.634 -1.166 . . . . 25.0 109.684 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.7 t -153.53 130.18 5.63 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 105.653 -1.98 . . . . 25.0 105.653 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -65.2 132.13 14.46 Favored 'Cis proline' 0 C--N 1.346 0.433 0 CA-C-N 118.783 0.601 . . . . 25.0 111.09 -0.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.37 111.14 3.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.074 -0.512 . . . . 25.0 111.887 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 t -72.21 157.52 37.58 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 109.06 -0.718 . . . . 25.0 109.06 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.44 -24.66 31.82 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.625 0.77 . . . . 25.0 111.757 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.07 -54.61 23.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.933 0.873 . . . . 25.0 109.52 176.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.23 -37.18 84.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.175 -0.921 . . . . 25.0 110.204 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -62.52 -33.29 74.59 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 122.313 -0.242 . . . . 25.0 110.963 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -39.39 93.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.011 0.434 . . . . 25.0 110.725 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.04 -35.49 74.33 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.183 0.516 . . . . 25.0 109.669 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.1 mt -74.58 2.61 9.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.162 -0.472 . . . . 25.0 111.561 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 58.19 23.39 10.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.413 1.485 . . . . 25.0 112.926 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.0 mt -84.96 -21.82 29.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 173.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -124.02 158.75 31.4 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.243 -2.132 . . . . 25.0 105.243 176.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 p -136.94 176.59 8.57 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.431 -0.581 . . . . 25.0 109.431 -177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 70.51 4.93 5.16 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.579 1.696 . . . . 25.0 115.579 174.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -67.83 -32.54 73.15 Favored 'General case' 0 CA--C 1.496 -1.113 0 O-C-N 121.354 -0.841 . . . . 25.0 110.563 172.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.19 -63.58 1.34 Allowed Glycine 0 C--O 1.215 -1.063 0 O-C-N 123.923 0.765 . . . . 25.0 112.151 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.6 t -88.08 -52.59 5.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.366 1.079 . . . . 25.0 112.343 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -65.97 -15.29 18.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.57 -1.196 . . . . 25.0 112.849 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HG2' ' H ' ' A' ' 26' ' ' GLN . 14.6 pt20 -84.33 -3.03 58.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.916 -0.49 . . . . 25.0 111.464 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -117.21 -35.65 3.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.182 -0.607 . . . . 25.0 110.264 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -127.0 94.06 40.33 Favored Pre-proline 0 C--O 1.243 0.76 0 N-CA-C 111.83 0.308 . . . . 25.0 111.83 171.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.2 Cg_endo -74.02 -20.64 19.13 Favored 'Trans proline' 0 C--N 1.346 0.396 0 N-CA-C 115.121 1.162 . . . . 25.0 115.121 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -83.74 9.34 12.04 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.851 -0.531 . . . . 25.0 112.123 -177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.8 m -66.65 -16.05 63.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.789 0.663 . . . . 25.0 112.789 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.6 m -63.97 125.35 20.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.759 1.022 . . . . 25.0 113.759 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -152.95 153.64 33.39 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 105.891 -1.892 . . . . 25.0 105.891 178.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.4 -167.66 16.69 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 108.891 -1.684 . . . . 25.0 108.891 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.0 tp -123.92 142.04 51.5 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.261 1.03 . . . . 25.0 111.506 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.07 157.0 29.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.822 -1.177 . . . . 25.0 107.822 172.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 132.19 6.98 2.97 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 114.804 -1.089 . . . . 25.0 113.507 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -75.77 139.65 70.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 O-C-N 121.564 -0.963 . . . . 25.0 108.889 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -91.87 -15.56 18.95 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 N-CA-C 115.826 1.433 . . . . 25.0 115.826 -5.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -69.18 -36.71 77.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.15 1.537 . . . . 25.0 115.15 -169.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.14 30.28 7.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.641 -1.985 . . . . 25.0 105.641 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.36 -178.0 42.95 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.397 -1.274 . . . . 25.0 110.824 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -62.1 171.75 4.76 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 122.957 2.438 . . . . 25.0 113.391 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.92 160.02 31.12 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.8 -1.556 . . . . 25.0 106.8 173.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.73 138.7 58.07 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 107.694 -1.224 . . . . 25.0 107.694 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.68 -4.71 81.36 Favored Glycine 0 CA--C 1.51 -0.258 0 C-N-CA 121.267 -0.492 . . . . 25.0 113.045 -174.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -124.01 10.02 8.78 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.74 -0.837 . . . . 25.0 108.74 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.68 -49.77 75.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.716 -0.22 . . . . 25.0 111.516 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.07 -21.47 56.71 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.813 -0.554 . . . . 25.0 109.732 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.6 p -82.75 -8.01 59.62 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.565 0.58 . . . . 25.0 112.565 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.19 33.49 12.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.594 0.757 . . . . 25.0 110.547 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.16 39.12 26.3 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.838 1.422 . . . . 25.0 114.838 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -121.38 135.46 55.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.025 -0.534 . . . . 25.0 110.654 175.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -62.24 -34.4 76.45 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 115.05 1.5 . . . . 25.0 115.05 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -70.66 -11.48 60.97 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.341 0.591 . . . . 25.0 112.275 -178.325 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -115.42 13.12 16.45 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 107.474 -1.306 . . . . 25.0 107.474 -178.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -70.74 -37.11 73.43 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.015 -1.053 . . . . 25.0 110.7 -175.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.9 mp0 -69.42 -15.3 63.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.746 0.784 . . . . 25.0 110.421 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.94 -7.67 57.96 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -113.2 -33.54 5.95 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.423 0.527 . . . . 25.0 112.423 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -94.31 121.68 36.08 Favored 'General case' 0 CA--C 1.505 -0.774 0 O-C-N 121.602 -0.686 . . . . 25.0 109.697 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.423 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -129.41 161.0 31.37 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.57 -0.741 . . . . 25.0 109.024 177.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.6 p -118.42 161.46 35.23 Favored Pre-proline 0 C--N 1.319 -0.748 1 N-CA-C 99.978 -4.082 . . . . 25.0 99.978 162.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -69.95 0.04 6.36 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 116.993 -1.538 . . . . 25.0 115.923 -174.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.2 t -127.29 9.25 6.66 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.336 0.495 . . . . 25.0 112.336 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -82.26 -31.15 30.29 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.094 1.146 . . . . 25.0 114.094 -175.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.423 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 15.0 m95 -119.61 164.95 15.09 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 110.41 -0.218 . . . . 25.0 110.41 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -67.54 120.09 13.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.908 -1.886 . . . . 25.0 105.908 171.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -94.7 103.09 15.0 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 100.849 -3.76 . . . . 25.0 100.849 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.18 135.09 55.04 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.935 -1.03 . . . . 25.0 110.397 -177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -89.59 100.88 13.59 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.515 -1.22 . . . . 25.0 107.921 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.4 mt -130.26 173.85 10.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 -176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.64 157.08 23.58 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.584 -0.734 . . . . 25.0 111.008 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.405 HG21 ' HA ' ' A' ' 139' ' ' ALA . 58.6 p -77.12 167.12 22.31 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 106.703 -1.591 . . . . 25.0 106.703 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.14 -160.62 24.03 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 110.487 -1.045 . . . . 25.0 110.487 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.06 132.57 48.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 119.122 1.461 . . . . 25.0 114.43 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -138.58 161.68 36.47 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.13 -1.804 . . . . 25.0 106.13 177.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.8 p -103.38 149.85 24.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -137.14 100.97 4.41 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 105.521 -2.029 . . . . 25.0 105.521 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.31 114.72 28.8 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.105 0.955 . . . . 25.0 110.065 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -98.88 146.68 25.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.148 -0.933 . . . . 25.0 109.593 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -125.29 110.43 14.0 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 104.605 -2.368 . . . . 25.0 104.605 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -107.36 135.73 48.36 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.74 -0.664 . . . . 25.0 111.007 -172.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.6 t -98.93 16.15 23.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.856 0.836 . . . . 25.0 109.183 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -131.23 135.0 47.0 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.415 -0.587 . . . . 25.0 109.415 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -87.72 -11.98 46.63 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.391 0.515 . . . . 25.0 112.391 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 160.72 32.2 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.665 0.617 . . . . 25.0 112.665 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 155.96 39.75 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 116.101 1.889 . . . . 25.0 116.101 -171.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.7 t -102.55 159.24 15.62 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.973 -1.121 . . . . 25.0 107.973 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.3 t -117.9 -14.73 10.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.069 0.396 . . . . 25.0 112.069 172.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.3 t -171.23 153.61 3.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.022 0.439 . . . . 25.0 112.179 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -127.9 139.14 52.78 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 169.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -146.72 152.73 39.29 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.361 -0.977 . . . . 25.0 108.361 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -137.98 135.76 36.3 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.41 -1.7 . . . . 25.0 106.41 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.28 163.36 37.9 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.93 165.77 31.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 113.694 0.998 . . . . 25.0 113.694 -167.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 18.4 p -79.69 162.52 25.16 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 169.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -62.78 159.14 47.03 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.474 -0.784 . . . . 25.0 108.963 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.13 -25.54 31.42 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 116.194 -2.071 . . . . 25.0 113.985 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -113.93 32.03 6.14 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 122.811 0.444 . . . . 25.0 110.736 -175.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.491 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.2 p-90 -71.7 166.62 21.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.958 0.885 . . . . 25.0 112.818 -176.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.87 101.0 10.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.658 -1.155 . . . . 25.0 109.504 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.491 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -91.59 12.95 19.29 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 116.706 2.113 . . . . 25.0 116.706 -168.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.1 t -125.51 12.44 8.07 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.252 -1.018 . . . . 25.0 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.9 mp0 -114.09 157.12 43.02 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.374 -1.285 . . . . 25.0 107.886 -174.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.36 153.16 79.07 Favored 'Trans proline' 0 CA--C 1.533 0.451 0 O-C-N 121.953 0.449 . . . . 25.0 111.59 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 102.56 2.89 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.383 0.611 . . . . 25.0 111.932 -176.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.1 p -89.13 156.54 18.75 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.154 -1.054 . . . . 25.0 108.154 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -65.56 -25.89 67.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.265 0.555 . . . . 25.0 110.85 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.44 60.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.816 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.5 t -78.76 -7.68 58.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.37 0.507 . . . . 25.0 112.37 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 66.1 m-85 -101.63 158.05 16.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.469 1.285 . . . . 25.0 114.469 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -95.72 95.42 8.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 102.655 -3.091 . . . . 25.0 102.655 162.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.1 mt -66.15 -7.58 18.82 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.832 1.419 . . . . 25.0 114.832 -169.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.66 120.25 76.16 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 176.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.52 142.19 43.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.368 -2.621 . . . . 25.0 111.666 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -92.27 -12.31 32.92 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.249 0.462 . . . . 25.0 112.249 -175.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 69.3 m -148.05 64.71 1.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.367 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -88.93 130.97 35.34 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 118.496 -1.282 . . . . 25.0 109.062 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -119.79 99.08 6.42 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 103.689 -2.708 . . . . 25.0 103.689 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -94.02 91.83 7.05 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.6 118.84 37.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 104.424 -2.436 . . . . 25.0 104.424 173.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.35 81.8 0.41 Allowed Glycine 0 CA--C 1.502 -0.758 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.423 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.79 14.81 4.59 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.973 -0.632 . . . . 25.0 113.168 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.86 106.16 5.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.591 0.71 . . . . 25.0 109.691 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.6 123.94 90.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 105.353 -2.092 . . . . 25.0 105.353 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.79 168.87 23.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 N-CA-C 113.765 0.641 . . . . 25.0 113.765 -174.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.82 26.77 4.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.51 -17.05 0.29 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 125.823 1.649 . . . . 25.0 112.188 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.9 mt-30 -128.21 153.13 47.26 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.034 -2.58 . . . . 25.0 104.034 169.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.8 t -142.82 95.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.2 t -94.01 126.64 39.35 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.74 166.99 21.68 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.416 -2.068 . . . . 25.0 105.416 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -130.71 154.39 48.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.581 -2.007 . . . . 25.0 105.581 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.63 160.19 36.24 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.628 -1.249 . . . . 25.0 107.628 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -104.38 116.43 32.12 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.192 0.307 . . . . 25.0 111.346 -176.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.4 mt -77.29 132.4 70.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.121 -1.066 . . . . 25.0 108.121 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -61.14 146.43 97.59 Favored 'Trans proline' 0 C--N 1.354 0.846 0 CA-C-O 121.655 0.606 . . . . 25.0 113.547 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.405 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.85 -26.11 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.197 -0.91 . . . . 25.0 112.802 -168.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.9 p-10 -84.16 9.69 12.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.545 0.688 . . . . 25.0 110.153 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.2 53.39 0.83 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.76 0.791 . . . . 25.0 108.977 172.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -86.04 169.32 13.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.409 -1.33 . . . . 25.0 107.409 175.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.75 -167.72 37.04 Favored Glycine 0 N--CA 1.451 -0.338 0 N-CA-C 115.733 1.053 . . . . 25.0 115.733 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -85.95 107.81 17.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.534 0.683 . . . . 25.0 110.478 -169.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 45.7 p-80 -157.21 171.92 19.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.678 -0.692 . . . . 25.0 110.512 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.9 p -108.03 150.64 10.54 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.125 -1.065 . . . . 25.0 108.125 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.8 mt -132.04 122.7 49.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 104.247 -2.501 . . . . 25.0 104.247 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.6 mp -105.05 127.68 52.99 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.588 -0.733 . . . . 25.0 110.004 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.16 127.59 55.98 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.851 -0.796 . . . . 25.0 108.851 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.63 140.62 46.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 122.075 0.94 . . . . 25.0 112.016 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -117.77 119.4 34.79 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.09 124.18 42.49 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.673 -0.862 . . . . 25.0 108.673 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.9 mm -76.75 141.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.084 -0.71 . . . . 25.0 109.084 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.69 -44.96 22.41 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.192 0.905 . . . . 25.0 110.482 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.14 -21.35 64.93 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -171.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 56.1 p -138.45 169.53 17.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.85 0.833 . . . . 25.0 109.765 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.66 23.2 0.54 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.284 -0.871 . . . . 25.0 112.107 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -94.94 144.12 25.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.36 143.77 16.64 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 104.513 -2.402 . . . . 25.0 104.513 172.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -145.87 134.87 22.62 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.739 0.644 . . . . 25.0 112.739 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.76 113.94 26.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.492 -0.776 . . . . 25.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.02 108.0 20.64 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.04 141.9 31.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.461 -0.79 . . . . 25.0 111.511 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.0 tt -125.37 133.84 68.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.478 -2.045 . . . . 25.0 105.478 167.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -93.7 131.26 39.2 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.1 m -132.59 161.07 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -175.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -117.64 95.02 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 103.67 -2.715 . . . . 25.0 103.67 167.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.57 163.82 14.44 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.027 -0.533 . . . . 25.0 112.29 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.7 p -145.68 163.37 35.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.015 -1.106 . . . . 25.0 108.015 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 CA-C-O 118.085 -0.96 . . . . 25.0 110.821 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 m80 . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 110.294 -0.262 . . . . 25.0 110.294 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 142.78 169.74 12.47 Favored Glycine 0 C--O 1.229 -0.199 0 N-CA-C 103.283 -3.927 . . . . 25.0 103.283 -173.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -146.14 167.87 22.38 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.886 1.843 . . . . 25.0 109.793 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.92 125.11 64.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 107.103 -1.443 . . . . 25.0 107.103 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.93 -42.6 48.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.945 -1.025 . . . . 25.0 109.951 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.3 t -153.59 129.49 5.28 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 105.755 -1.943 . . . . 25.0 105.755 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -64.24 131.95 12.68 Favored 'Cis proline' 0 CA--C 1.533 0.432 0 C-N-CA 128.774 0.739 . . . . 25.0 111.373 -0.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.54 109.96 3.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.016 -0.538 . . . . 25.0 111.477 -173.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -72.0 162.42 29.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.559 -0.534 . . . . 25.0 109.559 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -60.0 -22.28 62.38 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.089 0.471 . . . . 25.0 111.765 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.53 19.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.809 -0.812 . . . . 25.0 108.809 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -64.93 -37.76 88.71 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.659 -0.7 . . . . 25.0 110.411 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -63.06 -32.14 73.44 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.311 -0.243 . . . . 25.0 111.058 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -39.62 92.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.051 0.453 . . . . 25.0 110.325 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.451 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.3 tmtm? -69.84 -34.22 73.35 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.168 0.509 . . . . 25.0 109.975 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -75.16 2.88 9.75 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.374 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.71 10.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.405 1.482 . . . . 25.0 112.778 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.6 mt -86.85 -21.71 26.23 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.335 -1.357 . . . . 25.0 107.335 173.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.0 m-20 -122.95 157.35 32.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.337 -2.097 . . . . 25.0 105.337 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.2 p -135.6 176.21 8.88 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.987 -0.375 . . . . 25.0 109.987 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 72.15 5.29 5.27 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.096 1.517 . . . . 25.0 115.096 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -69.13 -39.7 78.71 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 121.734 -0.604 . . . . 25.0 110.908 173.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.99 -63.76 2.0 Favored Glycine 0 C--O 1.217 -0.908 0 N-CA-C 111.831 -0.508 . . . . 25.0 111.831 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.3 p -87.98 -52.98 4.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.466 1.127 . . . . 25.0 111.953 -178.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 29' ' ' PRO . 1.0 OUTLIER -68.2 -11.61 14.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.324 -1.307 . . . . 25.0 112.708 -171.818 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.22 -0.76 57.21 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.918 -0.489 . . . . 25.0 111.896 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -117.12 -35.44 4.07 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.679 -0.809 . . . . 25.0 109.845 172.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -127.04 94.8 38.38 Favored Pre-proline 0 CA--C 1.543 0.68 0 N-CA-C 111.797 0.295 . . . . 25.0 111.797 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.451 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 96.5 Cg_endo -71.83 -19.92 26.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 N-CA-C 115.111 1.158 . . . . 25.0 115.111 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.54 9.3 13.92 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 121.804 -0.56 . . . . 25.0 112.219 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.8 m -67.61 -14.67 63.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.7 m -64.11 131.9 29.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.238 0.829 . . . . 25.0 113.238 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -152.94 149.21 27.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.266 -1.012 . . . . 25.0 108.266 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.71 -168.3 17.83 Favored Glycine 0 N--CA 1.452 -0.233 0 N-CA-C 109.503 -1.439 . . . . 25.0 109.503 -178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.92 149.78 49.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.732 0.766 . . . . 25.0 111.213 -177.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.53 156.89 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.217 -1.401 . . . . 25.0 107.217 171.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.52 -0.14 3.4 Favored Glycine 0 C--N 1.318 -0.462 0 CA-C-N 115.099 -0.955 . . . . 25.0 113.373 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -75.93 146.44 79.24 Favored Pre-proline 0 C--N 1.321 -0.653 0 O-C-N 121.678 -0.895 . . . . 25.0 108.669 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.56 -16.97 16.52 Favored 'Cis proline' 0 CA--C 1.542 0.907 0 N-CA-C 115.834 1.436 . . . . 25.0 115.834 -5.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -74.09 -36.91 64.29 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.343 1.238 . . . . 25.0 114.343 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -111.63 32.86 5.11 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.322 -2.103 . . . . 25.0 105.322 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.29 -177.38 47.31 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.375 -1.284 . . . . 25.0 110.67 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -62.85 172.75 4.41 Favored 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 122.812 2.342 . . . . 25.0 113.784 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.08 30.96 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 106.44 -1.689 . . . . 25.0 106.44 173.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 139.47 58.05 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.489 -1.232 . . . . 25.0 108.072 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.89 -2.82 87.05 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 121.487 -0.387 . . . . 25.0 112.614 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 47.2 m170 -125.82 9.79 7.63 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.277 -0.543 . . . . 25.0 110.348 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.0 mt -66.29 -45.27 90.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 O-C-N 122.028 -0.42 . . . . 25.0 111.04 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.12 -23.43 57.89 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.863 -0.523 . . . . 25.0 109.882 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.0 p -82.83 -7.53 59.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.57 35.19 17.33 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.568 0.747 . . . . 25.0 110.499 -173.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 60.63 36.04 19.75 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -177.816 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -118.71 131.25 56.14 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 122.067 -0.395 . . . . 25.0 110.65 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -61.61 -32.28 72.4 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 113.922 1.082 . . . . 25.0 113.922 -176.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -69.19 -9.98 55.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.821 0.674 . . . . 25.0 112.821 -178.711 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.731 ' HA ' HD13 ' A' ' 59' ' ' LEU . 11.4 m-85 -121.7 16.37 11.09 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.79 -36.19 67.55 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.172 -0.955 . . . . 25.0 110.605 -177.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 mp0 -70.76 -16.63 62.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.088 0.947 . . . . 25.0 108.906 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.731 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -88.85 -2.36 58.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.095 -0.957 . . . . 25.0 108.902 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -112.1 -31.98 6.71 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -96.07 118.17 32.13 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.731 -0.606 . . . . 25.0 110.55 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.458 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.78 161.05 26.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.64 -0.709 . . . . 25.0 109.598 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.1 p -117.2 162.34 28.45 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 100.572 -3.862 . . . . 25.0 100.572 163.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.28 -4.96 14.75 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 116.756 -1.696 . . . . 25.0 115.972 -174.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -127.88 13.63 6.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.81 0.814 . . . . 25.0 111.022 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -77.81 -29.14 50.58 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.37 -0.831 . . . . 25.0 112.55 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.458 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.0 m95 -127.54 168.16 15.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 110.068 -0.345 . . . . 25.0 110.068 -178.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -67.94 120.94 15.03 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 106.6 -1.63 . . . . 25.0 106.6 171.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -95.8 104.76 16.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 100.358 -3.942 . . . . 25.0 100.358 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.83 134.95 53.14 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 114.857 -1.065 . . . . 25.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.05 99.86 12.79 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.56 -1.2 . . . . 25.0 107.925 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.3 mt -131.89 173.92 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 105.759 -1.941 . . . . 25.0 105.759 -176.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -116.51 168.95 9.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.576 0.703 . . . . 25.0 112.57 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.4 p -77.15 173.07 12.26 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 106.365 -1.717 . . . . 25.0 106.365 173.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.07 -162.23 33.64 Favored Glycine 0 C--O 1.241 0.546 0 C-N-CA 120.388 -0.911 . . . . 25.0 111.027 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.97 131.28 40.81 Favored 'Trans proline' 0 C--N 1.345 0.366 0 CA-C-N 118.869 1.334 . . . . 25.0 114.766 -175.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -138.17 161.39 36.95 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.8 p -104.85 152.03 23.11 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -139.31 101.01 4.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.969 -1.863 . . . . 25.0 105.969 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.91 110.16 22.2 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 122.063 0.935 . . . . 25.0 110.54 -178.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -93.96 147.69 22.87 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.28 -0.873 . . . . 25.0 110.113 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -125.34 110.13 13.62 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.741 -2.318 . . . . 25.0 104.741 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.0 mp -102.93 128.74 49.6 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.481 -0.782 . . . . 25.0 110.865 -171.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.8 t -85.58 3.9 38.59 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.105 0.479 . . . . 25.0 111.764 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.8 143.24 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.596 -0.52 . . . . 25.0 109.596 -177.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -84.13 -2.42 56.76 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.983 0.735 . . . . 25.0 112.983 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.97 158.76 24.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.075 0.769 . . . . 25.0 113.075 -176.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.7 t -75.78 155.97 34.98 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.367 1.247 . . . . 25.0 114.367 -172.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.5 t -103.37 155.98 18.08 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.6 -0.727 . . . . 25.0 109.615 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.4 t -117.79 -16.96 9.94 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 111.741 0.275 . . . . 25.0 111.741 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -171.34 154.31 3.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.069 0.461 . . . . 25.0 112.006 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -127.75 142.14 51.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 104.129 -2.545 . . . . 25.0 104.129 168.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -147.42 154.66 41.12 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.121 0.873 . . . . 25.0 108.93 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -137.91 139.01 39.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.888 -1.523 . . . . 25.0 106.888 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -148.9 164.33 34.82 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.573 0.624 . . . . 25.0 110.167 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.11 166.45 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -167.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 p -81.23 164.25 22.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.76 157.06 51.66 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.22 -0.9 . . . . 25.0 109.716 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -68.83 -20.07 39.94 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.891 -0.94 . . . . 25.0 114.535 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -120.96 32.02 6.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.228 0.455 . . . . 25.0 112.228 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.3 p-90 -74.95 164.86 26.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.694 0.759 . . . . 25.0 111.71 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -86.64 100.99 12.84 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.979 -1.01 . . . . 25.0 110.28 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -81.24 23.28 0.6 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 116.12 1.896 . . . . 25.0 116.12 -172.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.6 t -125.84 2.86 7.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.318 0.58 . . . . 25.0 110.482 175.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -108.69 157.02 37.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.329 -0.85 . . . . 25.0 109.477 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.4 153.21 78.13 Favored 'Trans proline' 0 C--N 1.348 0.539 0 O-C-N 121.943 0.444 . . . . 25.0 111.587 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 104.83 3.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.441 0.638 . . . . 25.0 112.313 -175.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.8 p -95.25 156.8 16.17 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 176.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -67.4 -25.17 65.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.3 0.571 . . . . 25.0 110.635 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.17 -25.13 63.29 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.277 -0.874 . . . . 25.0 111.858 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.4 t -85.05 -5.11 59.36 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.954 0.407 . . . . 25.0 111.807 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -103.11 153.83 19.91 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 114.993 1.479 . . . . 25.0 114.993 -174.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.35 90.02 4.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 102.604 -3.11 . . . . 25.0 102.604 163.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.0 -6.39 12.61 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.934 1.457 . . . . 25.0 114.934 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.2 t -80.13 132.68 59.17 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.165 -0.68 . . . . 25.0 109.165 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.8 149.8 48.72 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 114.94 -2.907 . . . . 25.0 110.82 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -102.63 -9.84 19.76 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.969 0.414 . . . . 25.0 111.425 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 54.5 m -150.36 67.89 0.97 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.451 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -89.02 132.88 34.55 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 118.87 -1.132 . . . . 25.0 108.788 175.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -121.68 99.06 6.25 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 104.166 -2.531 . . . . 25.0 104.166 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -89.65 92.11 8.94 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.134 -1.062 . . . . 25.0 108.134 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -109.17 118.28 36.33 Favored 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 107.428 -1.323 . . . . 25.0 107.428 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.69 80.87 0.42 Allowed Glycine 0 CA--C 1.501 -0.795 0 CA-C-N 115.568 -0.742 . . . . 25.0 112.963 -170.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.6 16.94 6.74 Favored Glycine 0 C--N 1.321 -0.289 0 C-N-CA 120.793 -0.717 . . . . 25.0 114.296 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.15 104.88 3.2 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.2 mt -68.68 122.33 84.37 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.27 170.54 19.34 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 117.748 -1.035 . . . . 25.0 113.694 -175.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.84 29.09 6.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.356 -0.979 . . . . 25.0 108.356 176.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.16 -15.67 0.33 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.693 1.597 . . . . 25.0 112.152 -174.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.424 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.1 mt-30 -128.59 152.47 48.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 103.598 -2.742 . . . . 25.0 103.598 170.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.3 t -141.38 95.11 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 107.013 -1.477 . . . . 25.0 107.013 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -84.92 134.72 34.25 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 105.514 -2.032 . . . . 25.0 105.514 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.47 165.77 26.35 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 105.626 -1.99 . . . . 25.0 105.626 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -135.5 152.22 51.12 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 104.705 -2.331 . . . . 25.0 104.705 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.87 160.24 30.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.38 -1.341 . . . . 25.0 107.38 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -103.44 118.87 37.74 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.111 0.257 . . . . 25.0 110.924 -177.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.0 mt -76.87 132.57 71.11 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.06 146.25 96.25 Favored 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-O 121.818 0.674 . . . . 25.0 113.456 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.75 -25.18 44.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.991 -1.004 . . . . 25.0 112.721 -169.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -84.48 7.98 18.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.682 -0.69 . . . . 25.0 110.119 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.6 mmt-85 -115.64 55.12 0.79 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 108.41 -0.959 . . . . 25.0 108.41 172.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.6 p -86.02 170.99 11.76 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.176 -1.787 . . . . 25.0 106.176 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.09 -169.53 44.15 Favored Glycine 0 C--N 1.32 -0.311 0 N-CA-C 115.64 1.016 . . . . 25.0 115.64 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.9 t -86.06 113.6 22.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.314 0.578 . . . . 25.0 110.86 -169.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.476 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 52.4 p-80 -159.92 171.78 18.79 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.956 -0.566 . . . . 25.0 111.049 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.6 p -105.01 151.16 7.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.348 -1.353 . . . . 25.0 107.348 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -134.63 128.33 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 102.475 -3.157 . . . . 25.0 102.475 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.8 mp -113.12 131.74 55.72 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 116.067 -0.515 . . . . 25.0 109.659 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.73 131.22 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 25.0 109.565 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -127.55 142.91 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 122.064 0.935 . . . . 25.0 112.525 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -115.57 119.66 36.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.84 -1.527 . . . . 25.0 107.104 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.91 121.89 39.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.086 -1.079 . . . . 25.0 108.086 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 13.1 mm -77.66 143.2 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.002 -0.74 . . . . 25.0 109.002 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.63 -42.9 27.56 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.971 0.805 . . . . 25.0 109.792 175.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.01 -23.7 65.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 114.075 1.139 . . . . 25.0 114.075 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 45.4 p -139.02 168.82 18.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.967 0.889 . . . . 25.0 110.374 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.4 18.7 1.09 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.181 -0.918 . . . . 25.0 112.246 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -90.06 146.59 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.71 138.6 10.83 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.797 -1.927 . . . . 25.0 105.797 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -138.79 132.97 31.49 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.126 0.421 . . . . 25.0 112.032 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -93.18 115.03 27.67 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.653 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -97.05 112.63 24.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.204 -0.665 . . . . 25.0 109.204 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.1 139.12 37.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.915 -0.584 . . . . 25.0 112.163 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -126.45 135.24 64.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.327 -2.101 . . . . 25.0 105.327 166.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -93.67 132.67 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.614 -1.254 . . . . 25.0 107.614 176.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -133.23 161.69 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.539 0.57 . . . . 25.0 112.539 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -120.98 95.04 4.54 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.784 -2.302 . . . . 25.0 104.784 170.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.7 tp -93.53 160.0 14.98 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 114.157 1.169 . . . . 25.0 114.157 -170.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.3 p -145.9 173.03 12.5 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.567 -0.531 . . . . 25.0 109.567 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.74 0 N-CA-C 108.609 -0.886 . . . . 25.0 108.609 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 15.8 m170 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 121.304 0.573 . . . . 25.0 110.752 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.65 167.52 35.38 Favored Glycine 0 C--N 1.322 -0.218 1 N-CA-C 102.147 -4.381 . . . . 25.0 102.147 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -146.1 166.49 25.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 120.071 1.936 . . . . 25.0 109.915 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.89 124.03 63.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.814 -1.18 . . . . 25.0 107.814 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -40.53 56.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.767 -1.106 . . . . 25.0 110.384 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -153.28 128.21 4.81 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -65.55 134.59 21.38 Favored 'Cis proline' 0 C--N 1.347 0.482 0 CA-C-N 118.814 0.612 . . . . 25.0 110.88 -0.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.09 4.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.105 -0.498 . . . . 25.0 111.079 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.7 p -72.13 164.41 26.23 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -59.55 -22.46 61.73 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.183 0.516 . . . . 25.0 111.777 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.71 -52.93 25.55 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.05 -0.722 . . . . 25.0 109.05 175.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -67.37 -35.07 78.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.019 -0.537 . . . . 25.0 110.928 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -63.97 -32.15 73.58 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.061 -0.4 . . . . 25.0 110.739 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -40.48 96.44 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.418 0.628 . . . . 25.0 109.496 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.58 -34.31 76.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.022 -0.535 . . . . 25.0 110.362 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.5 mt -79.78 5.3 13.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.575 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.49 23.02 10.28 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.029 1.331 . . . . 25.0 113.233 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -88.18 -21.03 24.8 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.741 -1.207 . . . . 25.0 107.741 174.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -123.62 159.53 29.07 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 105.148 -2.168 . . . . 25.0 105.148 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.4 p -135.16 175.64 9.4 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 122.215 0.206 . . . . 25.0 110.517 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 71.46 5.06 5.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.75 1.759 . . . . 25.0 115.75 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -68.26 -38.95 82.28 Favored 'General case' 0 CA--C 1.501 -0.92 0 O-C-N 121.53 -0.731 . . . . 25.0 111.392 175.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.95 -64.21 1.57 Allowed Glycine 0 C--O 1.218 -0.869 0 O-C-N 123.575 0.547 . . . . 25.0 112.087 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -87.98 -53.29 4.81 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.581 1.181 . . . . 25.0 111.599 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.13 -7.97 9.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.017 -172.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.83 2.74 53.11 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.825 -0.547 . . . . 25.0 111.527 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -119.72 -33.98 3.88 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.949 -0.7 . . . . 25.0 109.98 172.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -126.98 103.9 23.34 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 110.102 -0.333 . . . . 25.0 110.102 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.98 -21.11 21.2 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.034 -1.511 . . . . 25.0 114.678 -175.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.99 12.89 6.72 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.0 m -66.79 -13.77 61.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.829 0.307 . . . . 25.0 111.829 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 27.8 m -65.72 135.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 113.654 0.983 . . . . 25.0 113.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -153.06 151.55 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -157.92 -172.08 24.65 Favored Glycine 0 C--N 1.328 0.115 0 N-CA-C 110.575 -1.01 . . . . 25.0 110.575 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 tp -127.62 148.29 50.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.011 0.906 . . . . 25.0 112.011 -177.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.63 156.97 33.69 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.008 -1.108 . . . . 25.0 108.008 172.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 134.85 2.36 3.14 Favored Glycine 0 C--O 1.224 -0.489 0 CA-C-N 114.832 -1.076 . . . . 25.0 113.285 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -75.78 141.44 72.06 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 121.536 -0.979 . . . . 25.0 109.757 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -92.07 -18.37 12.98 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 N-CA-C 115.899 1.461 . . . . 25.0 115.899 -5.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -73.13 -35.19 66.47 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.043 1.497 . . . . 25.0 115.043 -168.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.93 38.23 3.72 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.16 -2.163 . . . . 25.0 105.16 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -111.9 -171.77 18.93 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 114.345 -1.298 . . . . 25.0 110.444 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.74 167.27 10.43 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.19 1.926 . . . . 25.0 114.739 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.02 159.97 31.09 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.727 -1.583 . . . . 25.0 106.727 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.11 139.24 57.62 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.287 -1.324 . . . . 25.0 108.914 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.49 -2.91 84.27 Favored Glycine 0 C--O 1.225 -0.415 0 CA-C-N 116.038 -0.528 . . . . 25.0 112.806 -175.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -124.5 11.73 8.63 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.473 -0.936 . . . . 25.0 108.473 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 59.5 mt -65.21 -54.35 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 112.61 0.596 . . . . 25.0 112.61 -171.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.26 -20.17 60.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.874 0.845 . . . . 25.0 108.798 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 t -74.56 -16.26 60.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.962 . . . . 25.0 111.792 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 55.26 26.24 8.3 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.38 0.672 . . . . 25.0 109.94 -172.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.57 35.78 22.66 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.781 1.232 . . . . 25.0 114.106 -176.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -122.3 133.97 54.67 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.183 0.593 . . . . 25.0 111.051 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -59.87 -31.96 70.26 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 115.092 1.515 . . . . 25.0 115.092 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.6 OUTLIER -70.09 -10.25 58.13 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.191 0.441 . . . . 25.0 112.191 -179.249 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.676 ' HA ' HD13 ' A' ' 59' ' ' LEU . 8.4 m-85 -123.63 16.23 9.54 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -71.12 -41.59 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.058 -1.026 . . . . 25.0 111.613 -174.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -73.43 -11.09 60.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.717 0.77 . . . . 25.0 109.722 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.676 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.9 mp -84.26 -6.61 59.42 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -114.83 -34.96 4.95 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.638 0.607 . . . . 25.0 112.638 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -89.42 113.5 24.85 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.651 -0.656 . . . . 25.0 111.094 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.0 pm0 -121.92 160.99 23.64 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.661 -0.7 . . . . 25.0 109.376 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -119.97 163.88 25.49 Favored Pre-proline 0 C--N 1.317 -0.825 1 N-CA-C 99.95 -4.093 . . . . 25.0 99.95 162.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.92 -5.78 17.11 Favored 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 116.196 -2.069 . . . . 25.0 115.669 -175.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -121.41 9.78 10.39 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.712 0.768 . . . . 25.0 111.115 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -77.78 -28.72 50.61 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.39 -0.819 . . . . 25.0 113.013 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 13.0 m95 -127.21 167.61 15.84 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.87 0.367 . . . . 25.0 111.717 -177.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -67.75 119.12 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 106.124 -1.806 . . . . 25.0 106.124 167.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -92.54 104.25 16.57 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 100.934 -3.728 . . . . 25.0 100.934 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.75 135.34 54.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.589 -1.187 . . . . 25.0 110.165 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -93.33 102.2 14.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.733 -1.121 . . . . 25.0 108.187 -177.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.6 mt -130.01 173.99 10.2 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.001 -1.111 . . . . 25.0 108.001 -176.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.46 156.89 26.05 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.55 -0.75 . . . . 25.0 111.562 -175.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.472 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.1 p -77.17 166.26 23.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.95 -1.5 . . . . 25.0 106.95 173.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.03 -164.5 21.57 Favored Glycine 0 C--O 1.239 0.454 0 N-CA-C 110.677 -0.969 . . . . 25.0 110.677 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.38 134.2 59.83 Favored 'Trans proline' 0 C--N 1.346 0.417 0 CA-C-N 118.972 1.386 . . . . 25.0 114.278 -177.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -140.84 161.66 37.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.309 -1.738 . . . . 25.0 106.309 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.2 p -105.4 152.12 23.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.837 -1.172 . . . . 25.0 107.837 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -139.45 101.02 4.13 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 105.967 -1.864 . . . . 25.0 105.967 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.39 108.77 20.15 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.79 0.805 . . . . 25.0 110.341 -178.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -97.75 148.67 23.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.602 -0.726 . . . . 25.0 110.094 -178.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -127.25 116.33 20.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 104.205 -2.517 . . . . 25.0 104.205 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -112.26 119.22 37.59 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.455 -0.793 . . . . 25.0 110.573 -173.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.01 18.58 3.48 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.507 0.67 . . . . 25.0 110.999 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.11 138.23 36.86 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.509 -0.552 . . . . 25.0 109.509 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -86.07 -7.15 58.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.488 0.922 . . . . 25.0 113.488 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.57 154.49 32.48 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.457 0.54 . . . . 25.0 112.457 -176.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.9 t -72.7 155.94 39.47 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -173.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.418 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.7 t -97.97 158.35 15.59 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 173.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.7 -14.98 10.17 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.041 0.213 . . . . 25.0 111.182 171.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -173.28 153.3 2.4 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.866 0.365 . . . . 25.0 111.826 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.07 139.08 54.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.225 -2.509 . . . . 25.0 104.225 166.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -143.08 148.18 36.24 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -137.92 132.36 32.29 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -149.52 164.01 36.25 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.65 0.659 . . . . 25.0 110.517 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.29 164.12 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -167.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.6 p -77.89 163.5 25.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.18 155.15 47.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.221 -0.899 . . . . 25.0 109.703 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -68.87 -23.01 35.56 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 117.404 -1.264 . . . . 25.0 113.633 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -113.09 32.07 5.99 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.607 0.363 . . . . 25.0 111.476 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 3.8 p-90 -82.28 163.06 22.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.674 0.75 . . . . 25.0 111.044 -177.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -93.28 100.98 13.23 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.096 -0.956 . . . . 25.0 110.574 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.484 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -74.01 19.92 0.11 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.817 1.784 . . . . 25.0 115.817 -175.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -112.52 -6.28 13.97 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 174.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -100.25 157.09 34.45 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.449 -0.796 . . . . 25.0 109.286 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 159.08 54.03 Favored 'Trans proline' 0 C--N 1.346 0.426 0 O-C-N 121.962 0.453 . . . . 25.0 112.241 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.98 99.95 1.89 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.076 0.465 . . . . 25.0 111.115 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.6 p -99.14 154.65 17.97 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.604 -0.887 . . . . 25.0 108.604 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -65.59 -25.62 67.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.255 0.55 . . . . 25.0 110.635 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.18 -25.19 63.31 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 25.0 111.973 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 30.8 t -89.6 -3.1 58.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.819 0.343 . . . . 25.0 111.597 -178.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -101.09 152.38 20.68 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.903 1.075 . . . . 25.0 113.903 -175.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -100.16 95.23 6.68 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 103.108 -2.923 . . . . 25.0 103.108 164.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -67.65 -6.4 20.32 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.195 1.183 . . . . 25.0 114.195 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.16 125.36 85.22 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 109.12 -0.696 . . . . 25.0 109.12 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -72.86 148.57 46.14 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 115.14 -2.773 . . . . 25.0 111.554 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -100.64 -14.77 18.0 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.5 m -147.35 64.42 1.15 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.568 -0.287 . . . . 25.0 111.101 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -89.08 138.59 31.28 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.457 -1.297 . . . . 25.0 108.825 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.59 99.54 6.05 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 103.552 -2.759 . . . . 25.0 103.552 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -92.09 91.87 8.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.692 -1.225 . . . . 25.0 107.692 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -110.25 118.03 35.26 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.67 80.46 0.46 Allowed Glycine 0 CA--C 1.502 -0.744 0 CA-C-N 115.459 -0.791 . . . . 25.0 113.791 -169.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.34 18.9 6.02 Favored Glycine 0 C--N 1.321 -0.263 0 C-N-CA 120.941 -0.647 . . . . 25.0 113.443 178.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.86 106.89 6.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.614 0.721 . . . . 25.0 109.427 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.1 mt -70.73 122.7 87.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 105.834 -1.913 . . . . 25.0 105.834 176.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.5 169.24 21.39 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 118.125 -0.783 . . . . 25.0 113.94 -174.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.0 22.54 6.46 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.852 -0.613 . . . . 25.0 109.542 176.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.55 -17.46 0.28 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 125.716 1.607 . . . . 25.0 112.739 -176.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -128.96 150.06 50.55 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 103.172 -2.899 . . . . 25.0 103.172 168.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.9 t -140.33 94.99 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 38.1 m -89.64 121.5 31.88 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 174.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -132.33 166.95 20.76 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.63 -1.248 . . . . 25.0 107.63 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -132.83 155.73 48.45 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.432 -1.692 . . . . 25.0 106.432 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.48 160.53 23.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 47.7 m-20 -103.94 119.69 39.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.466 0.174 . . . . 25.0 110.57 -177.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.1 mt -76.69 131.06 74.69 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 107.117 -1.438 . . . . 25.0 107.117 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.65 145.92 91.88 Favored 'Trans proline' 0 C--N 1.352 0.751 0 CA-C-O 121.668 0.612 . . . . 25.0 113.384 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.83 -26.48 40.45 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.316 -0.856 . . . . 25.0 112.625 -169.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -82.38 7.11 14.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.6 -0.727 . . . . 25.0 110.275 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -118.59 51.82 1.07 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.268 -1.012 . . . . 25.0 108.268 172.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 9.3 p -85.89 170.99 11.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 106.086 -1.82 . . . . 25.0 106.086 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.01 -171.34 37.2 Favored Glycine 0 N--CA 1.452 -0.259 0 N-CA-C 115.444 0.937 . . . . 25.0 115.444 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.2 t -86.05 109.68 18.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.391 0.615 . . . . 25.0 110.512 -169.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.443 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.3 p-80 -158.26 171.06 20.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.974 -0.557 . . . . 25.0 111.941 -175.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.6 p -104.2 150.58 7.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.1 mt -133.25 121.92 43.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.6 132.91 52.06 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.608 -0.724 . . . . 25.0 109.78 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.25 135.23 53.27 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.193 -0.669 . . . . 25.0 109.193 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.98 144.6 37.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.922 0.868 . . . . 25.0 112.531 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.418 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 13.3 t90 -113.28 112.37 23.6 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.121 -1.807 . . . . 25.0 106.121 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -92.62 125.23 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.0 mm -81.46 141.53 15.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 109.578 -0.527 . . . . 25.0 109.578 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.46 -43.05 24.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.868 0.758 . . . . 25.0 110.409 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -23.92 64.69 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.611 0.967 . . . . 25.0 113.611 -172.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.4 p -138.86 169.99 16.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.912 0.863 . . . . 25.0 109.91 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.05 20.32 0.81 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.223 -0.899 . . . . 25.0 112.189 178.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -90.01 145.9 24.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.592 -0.693 . . . . 25.0 112.731 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.66 136.81 7.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.343 -1.725 . . . . 25.0 106.343 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -137.87 130.33 29.39 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.482 0.549 . . . . 25.0 112.482 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.07 117.59 28.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.65 -0.704 . . . . 25.0 110.605 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -97.13 115.91 28.39 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.801 -1.185 . . . . 25.0 107.801 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.95 142.97 27.59 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.8 136.7 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 104.505 -2.405 . . . . 25.0 104.505 166.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -99.47 129.83 45.68 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.0 m -133.5 162.19 40.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -116.03 95.05 4.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.912 -2.625 . . . . 25.0 103.912 166.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.77 163.09 14.59 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.104 -0.498 . . . . 25.0 112.164 -172.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.6 p -145.98 162.68 37.29 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.847 -0.797 . . . . 25.0 108.847 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.751 0 CA-C-O 118.005 -0.998 . . . . 25.0 111.05 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 m170 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.258 0.552 . . . . 25.0 110.967 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.54 169.98 40.01 Favored Glycine 0 CA--C 1.509 -0.333 1 N-CA-C 102.839 -4.104 . . . . 25.0 102.839 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -145.13 167.28 23.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.891 1.845 . . . . 25.0 109.3 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.75 124.67 64.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.477 -0.935 . . . . 25.0 108.477 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -75.2 -43.5 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.661 -1.154 . . . . 25.0 109.96 -175.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.5 t -152.74 129.27 5.43 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 105.798 -1.927 . . . . 25.0 105.798 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -64.77 132.87 15.45 Favored 'Cis proline' 0 C--N 1.346 0.4 0 CA-C-N 118.791 0.604 . . . . 25.0 110.895 -0.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 109.67 2.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.039 -0.528 . . . . 25.0 111.953 -172.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 t -72.01 157.71 37.32 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -55.25 -25.25 32.46 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.562 0.745 . . . . 25.0 111.828 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.16 -53.52 36.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.659 0.742 . . . . 25.0 109.431 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -67.75 -35.04 78.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.714 -0.675 . . . . 25.0 110.626 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -63.56 -32.35 73.79 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 122.076 -0.39 . . . . 25.0 110.344 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -39.06 92.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 25.0 110.031 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.73 -35.81 79.43 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.058 -0.519 . . . . 25.0 109.821 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.7 mt -77.91 3.54 14.27 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.179 -0.464 . . . . 25.0 111.623 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 57.92 21.98 8.24 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.242 1.417 . . . . 25.0 113.245 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.6 mt -84.05 -21.37 31.6 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -123.78 158.59 31.41 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.812 -2.292 . . . . 25.0 104.812 176.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.6 p -136.6 176.02 9.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.918 -0.401 . . . . 25.0 109.918 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 71.97 5.21 5.28 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.516 1.672 . . . . 25.0 115.516 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 78.6 m -68.54 -36.7 79.17 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 121.585 -0.697 . . . . 25.0 111.154 174.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -62.96 1.45 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.681 0.613 . . . . 25.0 112.378 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.3 t -87.97 -53.74 4.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 122.564 1.173 . . . . 25.0 111.868 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.2 t -67.36 -12.37 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.41 -1.268 . . . . 25.0 113.116 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.4 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 14.0 pt20 -87.02 -2.26 58.5 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 121.808 -0.557 . . . . 25.0 111.75 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -117.26 -34.53 4.31 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 119.744 -0.782 . . . . 25.0 110.424 172.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -127.04 98.52 30.21 Favored Pre-proline 0 C--O 1.24 0.597 0 N-CA-C 110.414 -0.217 . . . . 25.0 110.414 170.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.83 -20.68 22.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 116.976 -1.549 . . . . 25.0 114.734 -174.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -82.88 8.83 11.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.845 -0.534 . . . . 25.0 112.384 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m -67.68 -14.65 63.12 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.553 0.575 . . . . 25.0 112.553 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 m -64.16 133.05 30.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 121.703 0.763 . . . . 25.0 112.56 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -153.0 156.06 38.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 105.922 -1.881 . . . . 25.0 105.922 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.17 -169.04 23.89 Favored Glycine 0 N--CA 1.453 -0.167 0 N-CA-C 108.98 -1.648 . . . . 25.0 108.98 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -128.2 148.65 50.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.148 0.974 . . . . 25.0 111.474 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.82 157.05 31.44 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 107.473 -1.306 . . . . 25.0 107.473 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -3.47 2.19 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.751 -1.113 . . . . 25.0 112.484 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -75.89 145.5 77.88 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 108.397 -0.964 . . . . 25.0 108.397 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.75 -19.16 12.07 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 N-CA-C 116.255 1.598 . . . . 25.0 116.255 -4.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -76.61 -35.26 58.18 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.724 1.379 . . . . 25.0 114.724 -169.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.0 30.35 7.11 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.58 -176.22 43.01 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.349 -1.296 . . . . 25.0 110.978 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -62.24 171.15 5.54 Favored 'Trans proline' 0 C--O 1.241 0.626 0 C-N-CA 122.796 2.331 . . . . 25.0 113.934 178.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 159.97 30.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 106.859 -1.534 . . . . 25.0 106.859 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.77 138.17 58.13 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 107.192 -1.41 . . . . 25.0 107.192 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.39 85.67 Favored Glycine 0 C--O 1.229 -0.21 0 C-N-CA 121.468 -0.396 . . . . 25.0 112.962 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -124.92 10.9 8.29 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.742 -0.466 . . . . 25.0 109.742 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 63.3 mt -64.95 -49.15 81.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 122.217 -0.302 . . . . 25.0 111.486 -173.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.24 -21.22 56.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.073 0.463 . . . . 25.0 109.898 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.7 p -83.46 -8.65 59.33 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.569 0.581 . . . . 25.0 112.569 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.63 32.6 12.09 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.556 0.742 . . . . 25.0 110.176 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.34 38.28 25.89 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.727 1.38 . . . . 25.0 114.727 -176.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.54 137.02 54.61 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.023 0.529 . . . . 25.0 110.942 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.41 -35.78 80.3 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 115.135 1.532 . . . . 25.0 115.135 -174.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -70.95 -7.18 44.16 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.529 0.566 . . . . 25.0 112.529 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.5 m-85 -121.47 11.96 10.74 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -72.55 -35.25 67.97 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.891 -1.131 . . . . 25.0 110.218 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.9 mp0 -70.83 -16.05 62.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.889 0.852 . . . . 25.0 109.576 174.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.82 -3.8 58.91 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.789 -0.819 . . . . 25.0 108.789 -177.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -115.1 -32.13 5.81 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.293 0.479 . . . . 25.0 112.293 173.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -91.64 118.08 30.31 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 121.496 -0.752 . . . . 25.0 109.854 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.451 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.9 pm0 -124.06 161.0 26.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.921 -0.581 . . . . 25.0 110.13 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -120.0 162.71 31.97 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 100.25 -3.981 . . . . 25.0 100.25 163.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.06 -7.17 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.775 -1.683 . . . . 25.0 115.786 -175.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -125.18 10.73 8.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.225 0.536 . . . . 25.0 112.018 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -77.32 -28.47 53.19 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.723 -0.61 . . . . 25.0 112.551 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 12.3 m95 -125.11 165.85 17.47 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 120.656 0.265 . . . . 25.0 110.814 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -68.83 120.97 15.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.97 -1.863 . . . . 25.0 105.97 170.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -94.48 103.87 15.83 Favored 'General case' 0 CA--C 1.499 -1.007 1 N-CA-C 99.997 -4.075 . . . . 25.0 99.997 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -66.19 134.58 53.02 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.024 -0.989 . . . . 25.0 110.512 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.83 99.42 12.29 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.715 -1.217 . . . . 25.0 107.715 -178.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.2 mt -130.9 173.94 10.47 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.275 -1.75 . . . . 25.0 106.275 -176.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -113.4 163.73 14.5 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.786 1.032 . . . . 25.0 113.786 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.487 HG22 HD23 ' A' ' 168' ' ' LEU . 77.9 p -77.05 170.81 15.86 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.745 -1.57 . . . . 25.0 106.953 175.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.09 -161.72 29.32 Favored Glycine 0 C--O 1.241 0.581 0 N-CA-C 111.144 -0.782 . . . . 25.0 111.144 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.68 131.34 41.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 118.935 1.368 . . . . 25.0 114.132 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -138.01 160.48 39.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.342 -1.725 . . . . 25.0 106.342 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.3 p -99.39 150.35 22.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.527 -1.286 . . . . 25.0 107.527 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -137.61 100.98 4.35 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 105.54 -2.022 . . . . 25.0 105.54 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.68 112.57 25.33 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.367 -0.833 . . . . 25.0 109.988 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.3 m95 -101.7 151.65 21.78 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 25.0 110.051 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -128.61 114.33 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 104.89 -2.263 . . . . 25.0 104.89 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -116.8 117.98 31.26 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.8 0.84 . . . . 25.0 112.085 -173.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.72 -32.71 69.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.454 0.645 . . . . 25.0 109.828 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.96 106.08 17.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 25.0 110.704 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -70.09 -0.12 7.11 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 115.161 1.541 . . . . 25.0 115.161 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.34 158.32 36.55 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.607 0.241 . . . . 25.0 111.613 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.2 t -67.79 156.09 37.82 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 116.053 1.872 . . . . 25.0 116.053 -170.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.437 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.5 t -99.1 161.05 13.84 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 114.856 -1.066 . . . . 25.0 108.241 172.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 t -117.97 -15.48 9.95 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.114 0.259 . . . . 25.0 111.081 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 t -172.81 155.39 3.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.965 0.412 . . . . 25.0 111.793 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 57.6 m95 -126.67 137.44 53.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 105.137 -2.171 . . . . 25.0 105.137 166.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -139.87 146.15 38.94 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.447 -0.945 . . . . 25.0 108.447 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -137.47 133.7 34.94 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.543 -1.651 . . . . 25.0 106.543 -176.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.99 161.49 42.23 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.557 0.617 . . . . 25.0 110.562 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.4 163.13 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 114.145 1.165 . . . . 25.0 114.145 -168.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.1 p -77.71 159.85 28.83 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.216 -1.031 . . . . 25.0 108.216 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -62.74 157.66 57.29 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.909 -1.042 . . . . 25.0 109.575 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -69.59 -18.24 37.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 N-CA-C 114.861 1.062 . . . . 25.0 114.861 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -118.73 31.85 6.44 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.615 0.366 . . . . 25.0 111.985 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -76.72 163.17 27.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.723 0.773 . . . . 25.0 111.5 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -85.95 101.31 12.78 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.899 -1.046 . . . . 25.0 110.297 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.82 21.67 0.66 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 116.059 1.874 . . . . 25.0 116.059 -173.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.0 t -125.36 0.42 7.69 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.475 0.655 . . . . 25.0 109.669 173.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -103.61 158.81 31.08 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.478 -0.934 . . . . 25.0 108.478 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.62 156.01 67.69 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 121.863 0.401 . . . . 25.0 112.66 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.76 100.87 1.58 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.964 0.412 . . . . 25.0 111.817 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 57.8 p -94.14 152.66 18.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -66.21 -25.17 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.342 0.592 . . . . 25.0 110.804 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.76 -24.61 63.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.348 -0.842 . . . . 25.0 112.093 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.9 t -83.35 -5.24 59.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.709 0.29 . . . . 25.0 111.777 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -102.94 154.02 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.344 1.238 . . . . 25.0 114.344 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -95.33 96.46 9.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 103.167 -2.901 . . . . 25.0 103.167 164.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.1 mt -69.01 -6.67 29.38 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -171.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.46 123.0 83.15 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 108.57 -0.9 . . . . 25.0 108.57 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 139.54 35.07 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 115.059 -2.827 . . . . 25.0 112.148 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -92.2 -12.51 32.56 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -176.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.3 m -147.58 66.88 1.12 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.317 -0.401 . . . . 25.0 110.071 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.01 135.05 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 118.727 -1.189 . . . . 25.0 108.978 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -125.18 99.39 6.07 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.895 -2.631 . . . . 25.0 103.895 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -91.16 91.91 8.44 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 106.694 -1.595 . . . . 25.0 106.694 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -111.76 116.99 31.62 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.114 0.959 . . . . 25.0 108.568 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.73 81.58 0.43 Allowed Glycine 0 CA--C 1.501 -0.818 0 CA-C-N 115.004 -0.998 . . . . 25.0 112.312 -172.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.14 15.04 4.81 Favored Glycine 0 C--O 1.228 -0.276 0 C-N-CA 120.867 -0.682 . . . . 25.0 114.086 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.01 104.06 5.44 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.266 -1.013 . . . . 25.0 108.266 176.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.4 mt -78.74 122.06 84.29 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 107.62 -1.252 . . . . 25.0 107.62 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.0 160.84 42.32 Favored 'Trans proline' 0 C--N 1.347 0.451 0 CA-C-O 121.505 0.544 . . . . 25.0 113.478 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.98 31.95 3.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.78 -4.58 1.66 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 113.618 -1.628 . . . . 25.0 111.435 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.06 152.33 48.71 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.438 -2.43 . . . . 25.0 104.438 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.5 t -141.39 95.09 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.221 -1.77 . . . . 25.0 106.221 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.8 t -85.43 140.98 30.29 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 104.69 -2.337 . . . . 25.0 104.69 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -156.98 166.91 32.02 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.81 -1.541 . . . . 25.0 108.705 -176.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -134.11 157.57 45.82 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.17 160.49 30.2 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -105.61 115.55 30.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.068 0.23 . . . . 25.0 111.034 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.2 mt -77.38 132.62 69.24 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 108.058 -1.09 . . . . 25.0 108.058 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.69 146.5 96.69 Favored 'Trans proline' 0 C--N 1.353 0.791 0 N-CA-C 113.766 0.641 . . . . 25.0 113.766 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -82.2 -25.78 33.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.164 -0.925 . . . . 25.0 112.768 -170.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -83.83 9.83 11.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.684 0.754 . . . . 25.0 110.115 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.2 mmt-85 -116.31 58.08 0.76 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.221 -1.029 . . . . 25.0 108.221 172.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.2 p -86.0 170.85 11.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 107.551 -1.278 . . . . 25.0 107.551 175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 81.89 -163.25 43.59 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.851 1.101 . . . . 25.0 115.851 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.1 t -85.71 107.45 17.59 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.288 0.566 . . . . 25.0 110.693 -168.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.441 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.1 p-80 -156.29 169.71 23.93 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.018 -0.537 . . . . 25.0 111.32 -177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -107.74 151.27 9.84 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.42 120.8 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.14 -2.17 . . . . 25.0 105.14 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -105.18 138.59 41.15 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.513 -0.767 . . . . 25.0 109.955 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -131.84 140.29 49.09 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.166 -0.679 . . . . 25.0 109.166 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -128.59 140.37 49.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.879 0.847 . . . . 25.0 112.358 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.437 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 16.6 t90 -103.42 113.12 26.37 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.395 -1.705 . . . . 25.0 106.395 173.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -94.48 119.95 33.97 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.4 mm -76.92 142.05 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 O-C-N 122.162 -0.336 . . . . 25.0 110.157 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.72 -44.34 20.96 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.551 0.691 . . . . 25.0 110.177 174.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.07 -24.63 65.08 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.778 1.399 . . . . 25.0 114.778 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.6 p -139.26 170.8 15.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 122.142 0.972 . . . . 25.0 110.648 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 18.79 1.25 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.883 -1.053 . . . . 25.0 112.386 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -89.94 148.87 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.727 -0.608 . . . . 25.0 112.172 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.29 143.0 10.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.619 -1.993 . . . . 25.0 105.619 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -146.83 133.8 20.26 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.192 0.441 . . . . 25.0 112.192 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -92.41 115.87 28.47 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.838 -0.619 . . . . 25.0 111.481 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -97.0 122.77 40.36 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.232 -1.025 . . . . 25.0 108.232 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -98.13 143.61 28.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.291 -0.413 . . . . 25.0 111.771 -177.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -125.72 136.49 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 106.144 -1.799 . . . . 25.0 106.144 167.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -97.06 130.58 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.6 -1.259 . . . . 25.0 107.6 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.74 162.66 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.904 0.705 . . . . 25.0 112.904 -174.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.79 95.07 4.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 104.964 -2.235 . . . . 25.0 104.964 168.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.487 HD23 HG22 ' A' ' 74' ' ' THR . 2.1 tp -92.31 158.83 15.89 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.259 1.207 . . . . 25.0 114.259 -169.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.3 p -145.9 165.35 29.2 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.622 -0.51 . . . . 25.0 109.622 176.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.76 0 CA-C-O 118.745 -0.645 . . . . 25.0 110.29 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.3 m80 . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 121.739 0.78 . . . . 25.0 110.429 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.98 167.24 31.83 Favored Glycine 0 C--N 1.318 -0.449 1 N-CA-C 100.05 -5.22 . . . . 25.0 100.05 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -144.25 158.61 43.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 120.484 2.142 . . . . 25.0 110.732 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.52 118.94 36.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 106.428 -1.693 . . . . 25.0 106.428 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -75.91 -41.25 52.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.166 -1.379 . . . . 25.0 109.608 -174.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 t -153.97 129.01 4.93 Favored Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 105.745 -1.946 . . . . 25.0 105.745 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HB2' HD13 ' A' ' 164' ' ' ILE . 65.3 Cg_endo -64.37 131.54 12.0 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.991 0.83 . . . . 25.0 111.316 -0.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 114.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.975 -0.557 . . . . 25.0 112.396 -172.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.0 t -71.98 158.0 36.8 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -55.78 -24.31 34.94 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.264 0.626 . . . . 25.0 111.822 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.79 -54.12 36.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.82 0.819 . . . . 25.0 109.288 175.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -69.03 -34.49 75.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.398 -0.819 . . . . 25.0 110.741 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.44 -33.35 75.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.98 -0.45 . . . . 25.0 110.517 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -39.9 95.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.243 0.545 . . . . 25.0 109.873 177.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -66.32 -36.5 83.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.222 0.534 . . . . 25.0 110.061 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.4 mt -77.27 4.87 9.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.41 176.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.53 24.11 11.55 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.309 1.444 . . . . 25.0 112.647 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -88.6 -21.38 24.05 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.841 -1.17 . . . . 25.0 107.841 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -122.95 159.21 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 106.613 -1.625 . . . . 25.0 106.613 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.2 p -132.86 175.48 9.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 122.597 0.359 . . . . 25.0 110.221 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 68.44 5.26 4.68 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.813 1.782 . . . . 25.0 115.813 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.7 m -68.16 -41.08 82.07 Favored 'General case' 0 CA--C 1.501 -0.91 0 O-C-N 121.299 -0.876 . . . . 25.0 111.017 173.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.67 -63.84 1.87 Allowed Glycine 0 C--O 1.218 -0.872 0 O-C-N 123.599 0.562 . . . . 25.0 111.93 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.5 t -87.94 -51.82 5.61 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 122.291 1.043 . . . . 25.0 112.043 -177.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.7 OUTLIER -66.97 -13.25 16.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 114.867 -1.06 . . . . 25.0 113.141 -172.168 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.86 -4.1 58.41 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.735 -0.603 . . . . 25.0 111.514 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -115.01 -34.03 5.21 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.419 -0.513 . . . . 25.0 110.322 174.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -126.95 95.57 36.73 Favored Pre-proline 0 C--O 1.243 0.754 0 CA-C-O 120.664 0.269 . . . . 25.0 110.412 171.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' VAL . 95.7 Cg_endo -72.51 -19.44 24.84 Favored 'Trans proline' 0 C--N 1.346 0.413 0 N-CA-C 115.097 1.153 . . . . 25.0 115.097 -174.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -91.34 14.14 15.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -176.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -62.89 -18.7 63.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.15 -0.477 . . . . 25.0 112.233 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.7 m -64.08 116.55 3.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 115.191 1.552 . . . . 25.0 115.191 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -153.09 157.44 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.15 -169.24 22.25 Favored Glycine 0 C--O 1.229 -0.168 0 N-CA-C 108.054 -2.018 . . . . 25.0 108.054 -177.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 tp -112.3 147.43 36.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.493 1.147 . . . . 25.0 112.301 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.76 156.97 31.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.676 -1.231 . . . . 25.0 107.676 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.92 -1.72 2.88 Favored Glycine 0 C--O 1.224 -0.501 0 CA-C-N 114.706 -1.134 . . . . 25.0 112.351 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -75.91 144.82 76.76 Favored Pre-proline 0 C--N 1.321 -0.649 0 O-C-N 121.664 -0.904 . . . . 25.0 110.073 -176.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -91.39 -18.07 14.67 Favored 'Cis proline' 0 CA--C 1.542 0.9 0 N-CA-C 115.585 1.34 . . . . 25.0 115.585 -6.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.46 -36.3 60.7 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.124 1.528 . . . . 25.0 115.124 -168.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.61 40.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.35 -167.58 16.69 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.219 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -59.79 168.27 5.84 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 123.1 2.533 . . . . 25.0 114.052 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.03 31.02 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.872 -1.529 . . . . 25.0 106.872 173.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -57.93 140.81 51.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.784 -1.098 . . . . 25.0 108.443 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.94 -4.05 81.68 Favored Glycine 0 C--O 1.225 -0.41 0 CA-C-N 116.012 -0.54 . . . . 25.0 113.091 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -124.25 10.33 8.66 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.456 -0.942 . . . . 25.0 108.456 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.6 mt -68.45 -51.27 48.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 122.311 -0.243 . . . . 25.0 111.25 -173.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.49 -20.23 60.73 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.886 -0.509 . . . . 25.0 109.772 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 p -84.21 -10.34 57.79 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.388 0.514 . . . . 25.0 112.388 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.42 36.15 15.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.631 0.772 . . . . 25.0 110.136 -171.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.4 t0 61.03 34.01 19.43 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.834 1.42 . . . . 25.0 114.834 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -119.26 135.2 54.81 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.952 -0.468 . . . . 25.0 111.658 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.8 p -61.05 -35.93 78.24 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -72.15 -7.27 48.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.239 0.542 . . . . 25.0 112.408 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.681 ' HA ' HD13 ' A' ' 59' ' ' LEU . 15.2 m-85 -120.39 12.26 11.63 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 107.024 -1.473 . . . . 25.0 107.024 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -72.23 -34.67 68.48 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.151 -0.968 . . . . 25.0 110.117 -175.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -70.09 -17.3 63.21 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 122.023 0.916 . . . . 25.0 110.011 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.2 -4.98 59.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.632 -0.877 . . . . 25.0 108.632 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -113.17 -32.06 6.43 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.096 0.474 . . . . 25.0 111.783 173.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -93.89 115.58 27.97 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.721 -0.612 . . . . 25.0 110.388 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.438 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -126.6 161.0 29.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.163 0.506 . . . . 25.0 109.792 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -118.2 161.99 32.14 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 100.45 -3.907 . . . . 25.0 100.45 162.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.02 -1.65 9.04 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 116.983 -1.545 . . . . 25.0 115.852 -174.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.7 t -127.97 12.57 6.72 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.734 0.778 . . . . 25.0 111.031 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -78.96 -30.06 44.3 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.306 -0.871 . . . . 25.0 113.121 -176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.438 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.1 m95 -124.81 165.23 18.38 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 110.309 -0.256 . . . . 25.0 110.309 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -66.44 127.62 33.0 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.454 -2.054 . . . . 25.0 105.454 170.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -101.68 107.96 19.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 100.418 -3.919 . . . . 25.0 100.418 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.19 135.37 53.38 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.915 -1.039 . . . . 25.0 110.139 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -90.41 100.89 13.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.596 -1.261 . . . . 25.0 107.596 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.1 mt -130.24 173.94 10.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.756 -1.572 . . . . 25.0 106.756 -176.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -115.26 166.46 11.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.654 0.74 . . . . 25.0 112.811 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.425 HG21 ' HA ' ' A' ' 139' ' ' ALA . 75.3 p -77.04 171.02 15.47 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.461 -1.681 . . . . 25.0 106.461 173.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.36 -162.53 33.49 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 120.585 -0.817 . . . . 25.0 111.452 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.57 131.29 39.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 118.82 1.31 . . . . 25.0 114.628 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -136.07 159.34 42.01 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.693 -1.966 . . . . 25.0 105.693 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.1 p -99.18 151.01 21.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.307 -1.368 . . . . 25.0 107.307 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -138.72 101.05 4.23 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.8 122.69 46.26 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.481 -0.933 . . . . 25.0 108.481 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -108.22 147.51 31.26 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.8 -1.091 . . . . 25.0 109.399 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -126.73 115.12 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.089 -2.559 . . . . 25.0 104.089 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -113.91 132.91 55.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.384 -0.825 . . . . 25.0 111.411 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.8 t -93.06 6.15 48.97 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.428 0.632 . . . . 25.0 109.992 173.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -118.48 138.33 52.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.026 0.441 . . . . 25.0 110.431 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -91.19 -9.19 46.3 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.635 0.606 . . . . 25.0 112.635 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -68.1 157.38 35.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.259 0.466 . . . . 25.0 112.259 -176.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.1 t -75.59 155.97 35.41 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 114.631 1.345 . . . . 25.0 114.631 -172.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.3 t -97.63 158.91 15.24 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.198 -0.91 . . . . 25.0 108.664 173.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -118.02 -15.24 9.94 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.149 0.281 . . . . 25.0 111.63 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 t -171.89 154.13 3.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.009 0.433 . . . . 25.0 111.507 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -127.13 142.01 51.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.537 -2.394 . . . . 25.0 104.537 167.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -147.12 154.57 41.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.668 -0.864 . . . . 25.0 108.668 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -137.96 136.79 37.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 106.379 -1.712 . . . . 25.0 106.379 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.98 161.87 41.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.284 0.493 . . . . 25.0 110.065 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.88 165.79 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 113.927 1.084 . . . . 25.0 113.927 -167.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -79.94 161.13 25.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 169.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.72 158.88 38.4 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.197 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.07 -19.15 39.78 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 117.4 -1.267 . . . . 25.0 114.231 -174.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -120.81 31.92 6.2 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 122.764 0.426 . . . . 25.0 111.554 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.493 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.7 p-90 -73.68 164.39 26.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.934 0.874 . . . . 25.0 112.68 -177.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.18 101.0 10.92 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.657 -1.156 . . . . 25.0 109.847 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.493 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.2 15.96 5.69 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.656 2.095 . . . . 25.0 116.656 -169.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.5 t -125.57 9.01 7.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.754 0.788 . . . . 25.0 109.12 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.7 156.18 41.92 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 114.585 -1.189 . . . . 25.0 107.943 -174.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.74 155.43 70.54 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 O-C-N 121.953 0.449 . . . . 25.0 111.673 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.41 101.09 2.83 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.587 0.708 . . . . 25.0 112.269 -175.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.9 p -89.59 155.9 18.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.255 -1.017 . . . . 25.0 108.255 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -64.34 -26.64 68.56 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.916 -0.49 . . . . 25.0 111.232 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.05 -25.13 63.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.583 -0.735 . . . . 25.0 112.464 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.8 t -79.44 -10.31 59.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.078 0.399 . . . . 25.0 112.078 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -99.4 155.87 17.31 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 114.323 1.231 . . . . 25.0 114.323 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -94.0 94.98 8.75 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 102.251 -3.24 . . . . 25.0 102.251 161.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.5 mt -66.18 -6.39 13.36 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.812 1.412 . . . . 25.0 114.812 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.5 t -85.75 127.51 62.39 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 108.602 -0.888 . . . . 25.0 108.602 176.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.44 150.3 57.79 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 115.644 -2.437 . . . . 25.0 111.459 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -101.72 -7.79 22.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.095 0.474 . . . . 25.0 111.362 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 57.3 m -148.67 68.95 1.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 25.0 109.764 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -89.08 125.37 34.99 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.705 -0.85 . . . . 25.0 108.705 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -118.92 98.92 6.43 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.058 -2.201 . . . . 25.0 105.058 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -87.96 92.05 8.99 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.019 -0.734 . . . . 25.0 109.019 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -109.67 118.83 37.59 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 106.814 -1.55 . . . . 25.0 106.814 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.54 82.51 0.34 Allowed Glycine 0 CA--C 1.5 -0.869 0 CA-C-N 115.601 -0.727 . . . . 25.0 112.862 -169.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.03 16.37 6.26 Favored Glycine 0 C--N 1.321 -0.293 0 C-N-CA 120.982 -0.628 . . . . 25.0 113.151 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.05 103.94 4.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 121.564 0.697 . . . . 25.0 109.525 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.67 125.29 91.3 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 106.164 -1.791 . . . . 25.0 106.164 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.53 167.47 26.47 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 118.197 -0.736 . . . . 25.0 113.749 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.73 26.95 4.68 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.71 -10.15 0.62 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.82 1.648 . . . . 25.0 111.656 -173.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.4 mt-30 -131.02 152.38 50.38 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 103.838 -2.652 . . . . 25.0 103.838 170.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -141.49 94.95 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 106.421 -1.696 . . . . 25.0 106.421 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -88.14 140.94 28.98 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 104.749 -2.315 . . . . 25.0 104.749 173.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.7 166.92 27.92 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.101 -1.814 . . . . 25.0 106.101 -177.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -134.49 152.96 52.13 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.722 -2.325 . . . . 25.0 104.722 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 158.86 34.76 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.515 -1.291 . . . . 25.0 107.515 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -105.29 116.58 32.19 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.247 0.342 . . . . 25.0 111.408 -174.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 57.7 mt -77.68 131.94 69.69 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -61.64 147.1 96.16 Favored 'Trans proline' 0 C--N 1.353 0.763 0 N-CA-C 113.762 0.639 . . . . 25.0 113.762 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.425 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.74 -27.26 40.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.079 -0.964 . . . . 25.0 112.696 -169.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -83.99 9.77 11.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.62 -0.718 . . . . 25.0 110.185 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -116.2 50.42 1.04 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 172.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 42.3 p -86.07 160.49 19.28 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 175.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 94.4 -168.49 28.24 Favored Glycine 0 C--O 1.237 0.326 0 N-CA-C 114.285 0.474 . . . . 25.0 114.285 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.5 t -86.14 114.89 23.35 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.352 0.596 . . . . 25.0 111.181 -169.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.9 p-80 -160.0 171.7 18.87 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.75 -0.659 . . . . 25.0 110.257 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -107.15 151.6 8.99 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 107.757 -1.201 . . . . 25.0 107.757 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.1 mt -132.93 121.9 45.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.57 129.87 52.6 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.635 -0.712 . . . . 25.0 109.748 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -114.6 130.82 56.82 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 108.973 -0.751 . . . . 25.0 108.973 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 1.7 p -125.46 137.55 57.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 122.043 0.925 . . . . 25.0 112.637 -177.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -111.92 118.46 35.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.77 -1.559 . . . . 25.0 106.954 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -98.63 125.31 43.87 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.539 -0.911 . . . . 25.0 108.539 178.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 21.7 mm -80.55 141.59 15.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.309 -0.626 . . . . 25.0 109.309 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.35 21.65 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.723 0.692 . . . . 25.0 110.476 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.01 -23.72 65.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.993 1.108 . . . . 25.0 113.993 -171.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.2 p -138.95 168.62 19.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.958 0.885 . . . . 25.0 110.248 -174.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.76 28.74 0.33 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.348 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -99.11 145.78 26.8 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.964 0.727 . . . . 25.0 112.964 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.3 146.13 15.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.279 -2.119 . . . . 25.0 105.279 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -148.16 138.11 22.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 111.87 0.322 . . . . 25.0 111.87 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.03 113.22 25.02 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 123.735 0.647 . . . . 25.0 111.205 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -97.06 111.9 23.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.981 -0.748 . . . . 25.0 108.981 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.42 141.13 30.19 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.467 0.543 . . . . 25.0 112.467 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' ILE . . . . . 0.418 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.3 tt -125.94 135.45 63.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 105.637 -1.986 . . . . 25.0 105.637 166.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -94.43 131.63 39.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.17 -1.419 . . . . 25.0 107.17 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.8 m -132.17 162.01 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.807 0.669 . . . . 25.0 112.807 -175.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -119.74 95.0 4.59 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.392 -2.447 . . . . 25.0 104.392 169.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.17 162.75 14.53 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 112.903 0.705 . . . . 25.0 112.903 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.4 p -145.92 161.1 40.81 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.425 -0.954 . . . . 25.0 108.425 174.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.888 -0.577 . . . . 25.0 110.558 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.476 0.655 . . . . 25.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.17 168.99 37.14 Favored Glycine 0 CA--C 1.509 -0.293 1 N-CA-C 101.691 -4.564 . . . . 25.0 101.691 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 p90 -146.83 165.06 30.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.318 2.059 . . . . 25.0 110.583 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.65 123.33 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.199 -1.037 . . . . 25.0 108.199 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.09 -43.08 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.63 -1.168 . . . . 25.0 109.883 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 t -154.24 129.2 4.94 Favored Pre-proline 0 C--N 1.321 -0.666 0 N-CA-C 106.35 -1.722 . . . . 25.0 106.35 177.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.404 ' HB2' HD13 ' A' ' 164' ' ' ILE . 67.3 Cg_endo -65.17 131.25 12.46 Favored 'Cis proline' 0 CA--C 1.532 0.418 0 C-N-CA 128.903 0.793 . . . . 25.0 110.92 -0.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.93 112.4 4.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.023 -0.535 . . . . 25.0 112.129 -172.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.9 t -72.23 157.84 36.98 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 107.566 -1.272 . . . . 25.0 107.566 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -55.48 -25.06 34.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.138 0.575 . . . . 25.0 112.238 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.61 -53.48 46.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.807 0.813 . . . . 25.0 109.447 175.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -70.39 -32.46 70.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.63 -0.714 . . . . 25.0 110.925 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -63.51 -32.4 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.847 -0.533 . . . . 25.0 110.374 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -40.3 96.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.38 0.609 . . . . 25.0 109.47 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -66.18 -36.15 82.32 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.887 -0.597 . . . . 25.0 110.206 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -78.24 5.3 10.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 25.0 111.518 177.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 58.35 24.45 11.66 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.158 1.383 . . . . 25.0 112.69 -179.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.6 mt -89.74 -21.65 22.57 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.933 -1.136 . . . . 25.0 107.933 174.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -122.93 159.12 28.94 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 106.581 -1.637 . . . . 25.0 106.581 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.2 p -133.04 176.51 8.43 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -175.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 71.94 0.09 3.41 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.624 1.713 . . . . 25.0 115.624 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.1 m -65.95 -43.33 88.29 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 121.633 -0.667 . . . . 25.0 111.745 175.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.73 -63.24 1.94 Allowed Glycine 0 C--O 1.218 -0.891 0 O-C-N 123.598 0.561 . . . . 25.0 111.939 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -87.67 -51.46 5.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.989 0.899 . . . . 25.0 111.857 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.3 t -66.66 -13.2 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.177 -0.92 . . . . 25.0 113.235 -172.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.87 -4.99 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.436 -0.79 . . . . 25.0 111.857 178.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -112.56 -34.07 5.95 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 25.0 109.515 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.3 100.45 29.46 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.399 -0.593 . . . . 25.0 109.399 172.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.1 -19.87 22.34 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.758 -1.028 . . . . 25.0 113.793 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -88.82 15.78 7.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.187 0.439 . . . . 25.0 112.187 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 71.2 m -63.22 -23.13 67.29 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.978 0.418 . . . . 25.0 111.585 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 4.4 m -64.04 122.0 14.1 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 115.371 1.619 . . . . 25.0 115.371 -175.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -152.88 159.04 42.98 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 174.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.03 -165.48 17.02 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 108.333 -1.907 . . . . 25.0 108.333 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.04 148.09 45.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.437 1.118 . . . . 25.0 112.546 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -67.27 156.87 35.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.336 -1.357 . . . . 25.0 107.336 171.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.32 -3.49 1.91 Allowed Glycine 0 C--O 1.224 -0.522 0 CA-C-N 114.816 -1.084 . . . . 25.0 112.309 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -75.93 144.06 75.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 O-C-N 121.826 -0.809 . . . . 25.0 108.861 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -91.48 -17.32 15.96 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 N-CA-C 115.581 1.339 . . . . 25.0 115.581 -5.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -70.67 -35.34 72.79 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.73 1.381 . . . . 25.0 114.73 -169.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -119.01 35.14 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.547 -2.02 . . . . 25.0 105.547 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.12 177.21 47.57 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.617 -1.174 . . . . 25.0 111.691 -177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.94 172.2 4.15 Favored 'Trans proline' 0 C--O 1.241 0.635 0 C-N-CA 123.924 3.082 . . . . 25.0 113.821 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.96 159.86 31.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.789 -1.56 . . . . 25.0 106.789 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.17 138.68 57.86 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.258 -1.337 . . . . 25.0 107.438 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.08 -4.7 82.48 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.258 -0.496 . . . . 25.0 113.063 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.406 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.2 m170 -124.27 9.27 8.55 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.253 -0.647 . . . . 25.0 109.253 178.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.3 mt -64.87 -49.49 79.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.703 -0.226 . . . . 25.0 111.259 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.58 -29.3 63.4 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 p -77.54 -8.29 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.596 0.962 . . . . 25.0 113.596 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.52 34.26 18.02 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.641 0.776 . . . . 25.0 109.816 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.29 38.51 26.02 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.956 1.465 . . . . 25.0 114.956 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -119.67 134.73 55.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.106 0.562 . . . . 25.0 111.108 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 p -62.29 -34.7 77.09 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.915 1.82 . . . . 25.0 115.915 -173.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' H ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -70.42 -7.66 44.86 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.251 0.548 . . . . 25.0 112.437 -177.773 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.695 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.8 m-85 -122.51 14.23 10.25 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 107.521 -1.289 . . . . 25.0 107.521 -178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.49 -38.17 71.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.227 -0.921 . . . . 25.0 110.405 -176.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -71.5 -17.34 62.35 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 122.032 0.92 . . . . 25.0 109.345 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.2 mp -83.61 -5.94 59.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.553 -0.906 . . . . 25.0 108.553 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -111.82 -32.06 6.74 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -96.58 116.45 29.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 121.471 -0.768 . . . . 25.0 111.127 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.459 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -122.64 160.55 25.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.881 -0.6 . . . . 25.0 109.466 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 6.1 p -116.93 162.57 26.78 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 100.541 -3.874 . . . . 25.0 100.541 162.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.55 -5.38 15.1 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 116.852 -1.632 . . . . 25.0 115.763 -175.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 t -125.67 12.38 7.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.291 0.567 . . . . 25.0 111.419 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -77.67 -29.44 51.55 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.817 0.673 . . . . 25.0 112.817 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.459 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.0 m95 -126.8 168.07 14.93 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 120.674 0.273 . . . . 25.0 110.505 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.0 t-20 -66.77 131.02 45.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 105.436 -2.061 . . . . 25.0 105.436 168.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -104.94 108.09 19.41 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 100.587 -3.857 . . . . 25.0 100.587 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.0 135.83 54.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 114.891 -1.05 . . . . 25.0 110.178 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -92.56 100.22 12.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.626 -1.17 . . . . 25.0 107.91 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.78 173.88 10.71 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.132 -1.803 . . . . 25.0 106.132 -176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -116.09 166.18 12.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.629 0.974 . . . . 25.0 113.629 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.408 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.3 p -77.04 169.14 18.87 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 174.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.96 -162.25 28.6 Favored Glycine 0 C--O 1.241 0.544 0 N-CA-C 111.078 -0.809 . . . . 25.0 111.078 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.08 133.32 52.46 Favored 'Trans proline' 0 C--N 1.346 0.422 0 CA-C-N 118.889 1.345 . . . . 25.0 114.212 -177.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -138.38 161.62 36.5 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.438 -1.69 . . . . 25.0 106.438 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -104.63 152.29 22.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.216 -1.401 . . . . 25.0 107.216 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -140.77 100.95 3.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.06 -1.83 . . . . 25.0 106.06 -176.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.46 113.8 27.58 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.83 0.824 . . . . 25.0 109.657 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.9 m95 -105.34 152.96 22.28 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.432 -0.804 . . . . 25.0 110.765 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -128.14 114.16 16.65 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.2 mp -115.85 104.92 12.11 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.297 -0.865 . . . . 25.0 112.812 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.9 t -70.91 -22.82 62.2 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.832 -0.803 . . . . 25.0 108.832 171.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.1 98.96 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 175.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -70.04 -18.9 63.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.297 1.221 . . . . 25.0 114.297 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -78.84 167.11 21.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.671 0.619 . . . . 25.0 112.671 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.6 t -64.54 155.54 32.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 117.254 2.316 . . . . 25.0 117.254 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 t -103.52 158.83 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 172.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.97 -12.76 10.07 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.398 0.518 . . . . 25.0 112.398 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.2 t -171.4 151.93 3.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.019 0.438 . . . . 25.0 112.171 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.5 m95 -127.23 139.76 52.69 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.105 -2.554 . . . . 25.0 104.105 167.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -145.82 144.59 30.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.37 -1.344 . . . . 25.0 107.37 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -133.86 134.47 42.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -149.29 163.13 38.56 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.556 -0.535 . . . . 25.0 109.556 178.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.85 165.12 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 113.685 0.994 . . . . 25.0 113.685 -168.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 16.6 p -79.11 161.69 26.33 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 169.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -61.14 159.04 31.54 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 25.0 109.205 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.72 -25.24 34.01 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 116.096 -2.136 . . . . 25.0 113.314 -175.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -114.43 32.06 6.2 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.034 0.534 . . . . 25.0 110.632 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.9 p-90 -73.24 167.41 21.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 122.029 0.918 . . . . 25.0 113.032 -176.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -83.16 101.08 10.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.447 -1.251 . . . . 25.0 109.59 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -93.48 8.56 40.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 14.1 t -118.03 9.76 12.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.401 -0.963 . . . . 25.0 108.401 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -115.11 157.76 42.72 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.115 -1.402 . . . . 25.0 107.599 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -65.67 157.46 58.55 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 O-C-N 121.982 0.464 . . . . 25.0 111.226 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.93 100.95 2.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.227 0.537 . . . . 25.0 111.722 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.1 p -89.31 156.99 18.37 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.305 -1.368 . . . . 25.0 107.305 174.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.66 -24.93 66.35 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.44 0.638 . . . . 25.0 110.762 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.7 -25.96 64.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.996 -1.002 . . . . 25.0 112.914 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 m -80.6 -8.34 59.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 25.0 112.396 -177.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 41.9 m-85 -98.13 154.28 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 115.158 1.54 . . . . 25.0 115.158 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -97.02 96.44 8.48 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 102.614 -3.106 . . . . 25.0 102.614 162.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.92 -7.28 20.94 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -169.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -80.65 132.28 58.56 Favored Pre-proline 0 C--N 1.323 -0.58 0 N-CA-C 109.122 -0.696 . . . . 25.0 109.122 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -73.74 152.3 47.33 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 115.069 -2.821 . . . . 25.0 111.082 177.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -107.46 -11.41 15.51 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.988 0.423 . . . . 25.0 111.49 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.3 m -149.32 67.91 1.03 Allowed 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.317 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.58 138.99 30.99 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.126 -1.03 . . . . 25.0 108.738 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.79 101.04 5.71 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 104.715 -2.328 . . . . 25.0 104.715 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -94.56 92.19 6.95 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.5 -0.926 . . . . 25.0 108.5 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -108.55 122.08 46.31 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 107.067 -1.457 . . . . 25.0 107.067 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.39 37.74 3.4 Favored Glycine 0 C--O 1.224 -0.489 0 N-CA-C 117.129 1.612 . . . . 25.0 117.129 -168.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 162.38 23.92 0.02 OUTLIER Glycine 0 C--N 1.319 -0.389 0 C-N-CA 120.354 -0.927 . . . . 25.0 113.452 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.62 104.16 9.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.381 0.61 . . . . 25.0 110.323 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 91.4 mt -75.47 123.57 88.62 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 104.894 -2.262 . . . . 25.0 104.894 173.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.75 165.34 33.01 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 117.725 -1.05 . . . . 25.0 113.577 -175.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.415 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.8 26.33 3.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 175.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.64 -8.43 0.92 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.987 1.715 . . . . 25.0 111.228 -173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.9 mt-30 -135.04 153.65 51.98 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.064 -2.569 . . . . 25.0 104.064 171.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.72 95.28 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.71 141.94 29.37 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 104.058 -2.571 . . . . 25.0 104.058 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.32 167.03 31.33 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.549 -1.659 . . . . 25.0 109.323 -176.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -134.54 157.38 46.69 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.655 -1.609 . . . . 25.0 106.655 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.46 160.89 26.8 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -108.22 114.98 29.28 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.333 0.396 . . . . 25.0 111.316 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.3 mt -78.58 132.76 64.36 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.68 -0.859 . . . . 25.0 108.68 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -62.35 147.44 94.94 Favored 'Trans proline' 0 C--N 1.354 0.841 0 CA-C-N 118.741 0.586 . . . . 25.0 113.611 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.408 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.55 -26.25 35.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 25.0 112.895 -169.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 p-10 -84.0 9.02 13.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 25.0 110.055 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -116.54 53.43 0.88 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 172.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.5 p -86.91 168.35 13.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 106.525 -1.657 . . . . 25.0 106.525 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 89.67 -167.55 33.76 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 115.535 0.974 . . . . 25.0 115.535 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.2 t -85.84 107.99 17.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.315 0.579 . . . . 25.0 110.707 -169.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -157.12 171.45 20.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.875 -0.602 . . . . 25.0 110.866 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.24 151.25 9.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 N-CA-C 107.816 -1.179 . . . . 25.0 107.816 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.8 mt -131.88 120.64 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 104.758 -2.312 . . . . 25.0 104.758 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.95 130.38 50.0 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.744 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.27 122.27 42.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.487 -0.931 . . . . 25.0 108.487 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.33 140.24 36.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 122.077 0.942 . . . . 25.0 110.197 -178.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -124.25 122.21 37.15 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.25 129.43 50.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 123.238 0.615 . . . . 25.0 109.963 -175.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 43.7 mm -78.06 140.93 16.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.681 -0.489 . . . . 25.0 109.681 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.41 -44.27 25.29 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.773 0.715 . . . . 25.0 111.027 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.26 -23.03 64.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 114.659 1.355 . . . . 25.0 114.659 -172.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.6 p -139.29 170.88 15.13 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.921 0.867 . . . . 25.0 109.707 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.82 23.06 0.56 Allowed 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.365 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -94.2 143.75 26.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.593 -0.692 . . . . 25.0 112.822 -176.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.28 145.58 16.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 104.647 -2.353 . . . . 25.0 104.647 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -147.52 140.01 24.63 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.083 0.771 . . . . 25.0 113.083 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -94.63 112.3 24.05 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.63 0.772 . . . . 25.0 111.496 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -97.06 108.21 20.9 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.38 141.08 29.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.311 -0.859 . . . . 25.0 111.83 -176.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' ILE . . . . . 0.404 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.4 tt -125.58 134.59 66.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.187 -1.783 . . . . 25.0 106.187 167.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.34 130.67 39.02 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.317 -1.364 . . . . 25.0 107.317 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.3 m -131.54 161.19 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 112.81 0.67 . . . . 25.0 112.81 -175.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -118.67 95.1 4.71 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 104.059 -2.571 . . . . 25.0 104.059 168.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -93.14 160.42 14.85 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 113.172 0.804 . . . . 25.0 113.172 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 65.6 p -145.97 167.17 23.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.77 -0.826 . . . . 25.0 108.77 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.869 -0.586 . . . . 25.0 109.94 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.8 m80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.248 -0.278 . . . . 25.0 110.248 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.01 170.59 12.9 Favored Glycine 0 C--N 1.322 -0.201 0 N-CA-C 103.507 -3.837 . . . . 25.0 103.507 -172.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -148.85 169.92 19.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 119.594 1.697 . . . . 25.0 111.385 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 126.11 62.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.031 -1.47 . . . . 25.0 107.031 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.64 -43.01 49.91 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.388 -0.824 . . . . 25.0 109.408 -175.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -153.56 133.57 7.62 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 105.503 -2.036 . . . . 25.0 105.503 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -65.25 135.46 23.53 Favored 'Cis proline' 0 CA--C 1.533 0.469 0 C-N-CA 128.754 0.731 . . . . 25.0 111.999 0.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.17 107.36 1.92 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.773 -0.649 . . . . 25.0 112.431 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 t -71.85 156.69 39.01 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.634 -0.506 . . . . 25.0 109.634 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 -55.4 -25.93 38.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.815 0.846 . . . . 25.0 112.444 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.25 -53.36 45.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.798 0.809 . . . . 25.0 109.134 175.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -66.37 -33.92 76.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.506 -0.77 . . . . 25.0 110.84 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.17 -33.2 75.24 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.948 -0.47 . . . . 25.0 110.244 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -37.52 84.83 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 178.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -62.66 -39.22 93.24 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.257 0.551 . . . . 25.0 109.857 175.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.2 mt -77.45 5.12 9.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.025 -0.534 . . . . 25.0 112.117 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 58.62 22.13 9.48 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.115 1.366 . . . . 25.0 112.814 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.1 mt -85.2 -20.16 30.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.895 -1.15 . . . . 25.0 107.895 174.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -121.81 156.72 32.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.314 -1.735 . . . . 25.0 106.314 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 p -134.58 175.98 9.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.366 -0.605 . . . . 25.0 109.366 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 68.08 5.01 4.36 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 175.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.2 m -67.25 -33.15 74.73 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 121.451 -0.781 . . . . 25.0 111.777 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.66 -62.61 1.55 Allowed Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.733 0.645 . . . . 25.0 112.376 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 t -91.75 -50.81 5.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 114.945 1.461 . . . . 25.0 114.945 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.98 -14.28 13.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.122 -1.399 . . . . 25.0 114.12 -165.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -79.45 -7.6 58.53 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.574 -0.85 . . . . 25.0 112.382 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -104.14 -38.92 6.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.229 -0.988 . . . . 25.0 111.048 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -131.21 95.98 23.2 Favored Pre-proline 0 C--O 1.241 0.641 0 N-CA-C 111.785 0.291 . . . . 25.0 111.785 168.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.26 -19.06 29.73 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 116.91 -1.593 . . . . 25.0 115.383 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -81.42 5.57 17.2 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 121.575 -0.703 . . . . 25.0 112.178 -178.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.4 m -66.45 -12.35 56.78 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.77 0.656 . . . . 25.0 112.77 177.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.05 132.88 29.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.881 0.848 . . . . 25.0 112.782 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -152.98 150.42 29.21 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.64 -168.38 17.92 Favored Glycine 0 CA--C 1.51 -0.261 0 N-CA-C 109.504 -1.439 . . . . 25.0 109.504 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -127.92 146.64 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.764 0.782 . . . . 25.0 111.174 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.98 157.01 29.42 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.176 -1.046 . . . . 25.0 108.176 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.27 -4.0 1.99 Allowed Glycine 0 C--N 1.318 -0.451 0 CA-C-N 114.726 -1.124 . . . . 25.0 112.847 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -75.96 148.09 81.29 Favored Pre-proline 0 C--N 1.321 -0.632 0 O-C-N 121.623 -0.928 . . . . 25.0 109.075 -177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -90.8 -18.64 14.53 Favored 'Cis proline' 0 CA--C 1.541 0.875 0 N-CA-C 115.95 1.481 . . . . 25.0 115.95 -4.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -77.77 -35.8 51.28 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.924 1.453 . . . . 25.0 114.924 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.02 33.27 5.33 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.364 -1.717 . . . . 25.0 106.364 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.07 -174.86 45.26 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.626 -1.17 . . . . 25.0 111.415 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -60.44 171.5 3.3 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 123.793 2.995 . . . . 25.0 113.322 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.14 159.98 30.99 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.23 137.38 58.0 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 106.652 -1.61 . . . . 25.0 106.652 176.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.21 -6.04 82.7 Favored Glycine 0 CA--C 1.509 -0.298 0 CA-C-O 121.416 0.453 . . . . 25.0 113.413 -174.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 51.0 m170 -125.02 10.04 8.15 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.404 -0.468 . . . . 25.0 110.218 179.209 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.8 mt -64.23 -48.77 84.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.443 -0.16 . . . . 25.0 111.232 -173.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.81 -24.34 55.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.072 0.463 . . . . 25.0 110.004 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.3 p -81.62 -8.61 59.73 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.031 0.752 . . . . 25.0 113.031 -176.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.89 34.79 17.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.714 0.805 . . . . 25.0 110.075 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.416 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.44 41.11 23.33 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -177.818 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -121.34 135.01 55.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.287 0.635 . . . . 25.0 110.781 174.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.56 -34.44 77.81 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 115.497 1.665 . . . . 25.0 115.497 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 t -71.42 -8.05 51.32 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.347 0.594 . . . . 25.0 112.346 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.705 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.3 m-85 -119.1 15.02 13.22 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.447 -1.316 . . . . 25.0 107.447 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.81 -37.89 70.31 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.1 -1.0 . . . . 25.0 110.401 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.4 mp0 -70.2 -16.31 63.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.879 0.847 . . . . 25.0 110.042 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.4 mp -86.16 -5.72 59.14 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -112.49 -32.31 6.52 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.104 0.409 . . . . 25.0 112.104 173.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -96.07 121.89 38.32 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 121.628 -0.67 . . . . 25.0 110.185 -178.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.453 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -128.03 160.87 30.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.504 -0.771 . . . . 25.0 109.731 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.3 p -114.39 161.19 29.75 Favored Pre-proline 0 C--N 1.319 -0.74 1 N-CA-C 100.11 -4.033 . . . . 25.0 100.11 161.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 -2.16 9.67 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 116.961 -1.56 . . . . 25.0 115.765 -174.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -127.34 11.73 6.94 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.231 0.539 . . . . 25.0 111.65 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -78.93 -31.05 45.05 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.028 0.751 . . . . 25.0 113.028 -176.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.9 m95 -122.58 167.17 13.73 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 110.047 -0.353 . . . . 25.0 110.047 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -68.19 125.0 24.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.009 -1.848 . . . . 25.0 106.009 172.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -100.44 106.11 17.65 Favored 'General case' 0 CA--C 1.5 -0.981 0 N-CA-C 100.511 -3.885 . . . . 25.0 100.511 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.32 135.75 52.36 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.97 -1.014 . . . . 25.0 110.81 -176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -88.89 100.84 13.49 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 107.912 -1.144 . . . . 25.0 107.912 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.77 174.05 10.33 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.883 -1.895 . . . . 25.0 105.883 -177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -115.42 166.51 11.8 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.687 0.995 . . . . 25.0 113.687 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 72.5 p -77.12 171.61 14.55 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 106.297 -1.742 . . . . 25.0 106.297 173.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.99 -161.35 33.05 Favored Glycine 0 C--O 1.24 0.517 0 C-N-CA 120.436 -0.888 . . . . 25.0 111.198 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.09 132.95 50.06 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 119.013 1.406 . . . . 25.0 114.392 -176.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -139.41 158.74 43.62 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.7 p -100.2 150.18 22.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -139.11 100.93 4.15 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 105.527 -2.027 . . . . 25.0 105.527 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.54 111.07 23.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.008 0.909 . . . . 25.0 111.004 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -97.8 147.42 24.41 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.305 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -124.01 110.55 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.602 -2.37 . . . . 25.0 104.602 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.44 130.91 45.74 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.166 -0.925 . . . . 25.0 109.478 -171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.7 t -72.73 -10.92 60.36 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.672 0.619 . . . . 25.0 112.672 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.98 147.6 27.35 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.805 -0.813 . . . . 25.0 108.805 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 mtm180 -81.22 13.68 2.74 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.287 0.847 . . . . 25.0 113.287 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.98 152.36 32.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.956 -0.757 . . . . 25.0 108.956 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.1 t -69.47 155.95 39.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.723 1.009 . . . . 25.0 113.723 -170.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.477 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 3.1 t -102.19 156.55 17.49 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.276 -1.379 . . . . 25.0 107.276 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.84 -15.94 10.0 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.168 0.293 . . . . 25.0 110.771 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 t -172.54 152.08 2.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.891 0.377 . . . . 25.0 111.975 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.67 140.71 52.72 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 103.687 -2.709 . . . . 25.0 103.687 166.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -145.82 150.97 37.15 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.089 0.859 . . . . 25.0 108.978 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -137.98 137.49 37.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.084 -1.821 . . . . 25.0 106.084 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -147.88 160.09 43.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.24 164.5 34.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.217 0.821 . . . . 25.0 113.217 -168.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 p -79.76 162.51 25.1 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.434 -0.95 . . . . 25.0 108.434 171.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -64.06 161.87 35.81 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.249 -0.887 . . . . 25.0 109.472 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.59 -18.73 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 116.505 -1.863 . . . . 25.0 113.812 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.83 32.01 6.16 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.129 0.571 . . . . 25.0 111.034 -177.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.475 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 10.4 p-90 -68.94 172.68 6.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.293 1.22 . . . . 25.0 114.293 -176.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -83.11 98.41 9.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.0 -1.0 . . . . 25.0 109.099 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.475 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -96.27 5.3 51.28 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.913 1.82 . . . . 25.0 115.913 -168.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -128.42 17.22 6.5 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -122.53 161.0 45.99 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 114.195 -1.366 . . . . 25.0 107.503 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.96 151.92 82.05 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 118.443 -0.571 . . . . 25.0 111.133 173.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 108.81 3.44 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.554 0.575 . . . . 25.0 112.554 -175.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.7 p -95.66 153.31 17.79 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.126 -1.065 . . . . 25.0 108.126 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -68.13 -22.59 64.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.422 0.63 . . . . 25.0 110.111 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.81 -29.65 68.87 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.943 -1.026 . . . . 25.0 112.28 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.76 -3.04 59.0 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.045 0.387 . . . . 25.0 112.045 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -100.01 152.27 20.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 114.021 1.119 . . . . 25.0 114.021 -177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -97.02 92.85 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.632 -2.729 . . . . 25.0 103.632 165.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.0 mt -66.66 -6.49 15.72 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.564 1.32 . . . . 25.0 114.564 -170.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.43 122.02 78.69 Favored Pre-proline 0 C--N 1.323 -0.543 0 N-CA-C 108.856 -0.794 . . . . 25.0 108.856 176.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.85 135.6 28.22 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 115.26 -2.693 . . . . 25.0 111.945 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -87.0 -13.62 43.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 -175.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.2 m -146.55 63.32 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.508 -0.314 . . . . 25.0 111.828 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -89.07 134.92 33.82 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 118.152 -1.419 . . . . 25.0 108.874 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -122.58 98.99 6.17 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 104.239 -2.504 . . . . 25.0 104.239 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -90.32 92.05 8.75 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.045 -1.095 . . . . 25.0 108.045 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -106.31 122.06 45.49 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.75 84.11 0.39 Allowed Glycine 0 CA--C 1.504 -0.602 0 CA-C-N 115.123 -0.944 . . . . 25.0 112.811 -171.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.56 15.63 13.31 Favored Glycine 0 C--N 1.32 -0.337 0 C-N-CA 120.901 -0.666 . . . . 25.0 113.464 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.13 106.73 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.366 -0.976 . . . . 25.0 108.366 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 79.2 mt -72.48 117.58 60.2 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 107.583 -1.266 . . . . 25.0 107.583 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -76.94 166.89 26.11 Favored 'Trans proline' 0 C--N 1.345 0.35 0 N-CA-C 114.682 0.993 . . . . 25.0 114.682 -176.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.44 26.39 4.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.763 -0.829 . . . . 25.0 108.763 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.72 -16.89 0.37 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.688 1.595 . . . . 25.0 112.33 -175.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -129.31 146.96 51.11 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 103.988 -2.597 . . . . 25.0 103.988 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.8 t -138.71 95.03 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -89.26 132.66 34.79 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 104.662 -2.348 . . . . 25.0 104.662 173.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -145.2 166.98 23.88 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -175.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -132.11 156.39 46.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.85 159.87 33.03 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -104.67 119.03 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.08 0.238 . . . . 25.0 111.191 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.27 132.81 61.7 Favored Pre-proline 0 C--O 1.24 0.6 0 N-CA-C 108.276 -1.009 . . . . 25.0 108.276 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -60.64 147.41 94.83 Favored 'Trans proline' 0 C--N 1.354 0.844 0 N-CA-C 113.84 0.669 . . . . 25.0 113.84 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.41 -26.46 35.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.159 -0.928 . . . . 25.0 112.717 -169.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -83.63 10.35 9.4 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.744 0.783 . . . . 25.0 110.208 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -115.97 51.4 0.96 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.43 -0.952 . . . . 25.0 108.43 172.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.4 p -86.24 162.22 18.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.582 -1.636 . . . . 25.0 106.582 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.6 -165.68 29.9 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 114.839 0.696 . . . . 25.0 114.839 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 37.4 t -85.85 110.85 19.68 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.491 0.662 . . . . 25.0 110.954 -168.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -157.39 170.98 21.22 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 115.72 -0.673 . . . . 25.0 110.493 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.63 151.54 11.88 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 107.725 -1.213 . . . . 25.0 107.725 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 58.8 mt -131.55 121.27 47.7 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 104.809 -2.293 . . . . 25.0 104.809 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -103.05 128.76 49.8 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.663 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.43 131.59 56.27 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 123.005 0.522 . . . . 25.0 109.804 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.42 145.76 34.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 122.125 0.965 . . . . 25.0 112.249 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.477 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 12.7 t90 -116.77 119.37 35.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 173.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.81 121.41 38.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 7.4 mm -77.28 143.51 12.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.156 -1.053 . . . . 25.0 108.156 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.54 -41.02 28.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.847 0.749 . . . . 25.0 109.637 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.16 -22.69 64.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.011 1.115 . . . . 25.0 114.011 -172.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -138.5 169.14 18.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.993 0.902 . . . . 25.0 110.236 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 17.96 1.45 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.162 -0.926 . . . . 25.0 111.969 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -90.03 144.65 25.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.915 0.709 . . . . 25.0 112.915 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.49 141.34 14.62 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.089 -2.189 . . . . 25.0 105.089 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -146.51 131.85 18.55 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 117.766 0.257 . . . . 25.0 111.432 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -89.95 117.32 28.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.955 -0.566 . . . . 25.0 110.916 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -96.96 107.99 20.62 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.1 140.79 32.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.641 -0.709 . . . . 25.0 111.999 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 134.4 66.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.404 -1.702 . . . . 25.0 106.404 168.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -92.47 132.21 36.98 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.886 -1.153 . . . . 25.0 107.886 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -133.54 161.74 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -176.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -120.64 95.0 4.54 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.637 -2.357 . . . . 25.0 104.637 169.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.58 160.1 16.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 113.277 0.843 . . . . 25.0 113.277 -170.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.4 p -145.8 166.58 25.51 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.821 -0.437 . . . . 25.0 109.821 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.709 -0.662 . . . . 25.0 110.333 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 47.0 m170 . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.963 0.411 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.66 30.97 Favored Glycine 0 N--CA 1.45 -0.377 1 N-CA-C 102.709 -4.156 . . . . 25.0 102.709 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -147.32 168.52 21.57 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 119.523 1.662 . . . . 25.0 109.276 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -105.28 122.83 59.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 108.147 -1.057 . . . . 25.0 108.147 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -72.22 -42.69 65.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.845 -1.071 . . . . 25.0 109.697 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 t -153.02 129.24 5.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -64.67 134.46 19.29 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 128.798 0.749 . . . . 25.0 111.585 -0.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 113.17 4.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.626 0.602 . . . . 25.0 112.626 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -72.11 155.03 40.73 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.104 -0.702 . . . . 25.0 109.104 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -56.74 -26.38 57.03 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.286 0.635 . . . . 25.0 112.163 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -48.41 63.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -66.38 -36.65 83.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.624 -0.716 . . . . 25.0 109.638 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.84 -33.43 75.66 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 122.228 -0.295 . . . . 25.0 110.587 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -39.64 93.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 25.0 109.96 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -66.63 -35.37 80.01 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.211 0.529 . . . . 25.0 110.071 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.4 mt -79.4 6.42 10.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.485 . . . . 25.0 111.731 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 59.09 21.45 9.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.056 1.343 . . . . 25.0 113.314 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.75 -20.62 25.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.996 -1.113 . . . . 25.0 107.996 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -123.33 158.95 29.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.075 -2.194 . . . . 25.0 105.075 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.1 p -135.38 174.68 10.34 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 122.307 0.243 . . . . 25.0 110.447 -175.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 69.71 5.08 5.03 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.978 1.844 . . . . 25.0 115.978 174.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.1 m -66.8 -39.25 87.69 Favored 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 121.483 -0.761 . . . . 25.0 110.491 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.87 -64.19 1.55 Allowed Glycine 0 C--O 1.217 -0.965 0 O-C-N 123.593 0.558 . . . . 25.0 112.303 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 t -88.01 -53.69 4.6 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.655 1.217 . . . . 25.0 111.592 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.2 OUTLIER -69.95 -6.9 7.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.32 -1.309 . . . . 25.0 113.377 -171.758 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.34 2.59 52.21 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.08 -0.387 . . . . 25.0 111.508 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -116.78 -37.93 3.54 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.4 -0.92 . . . . 25.0 111.383 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -127.51 93.68 39.99 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 122.047 0.139 . . . . 25.0 111.35 167.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' VAL . 83.5 Cg_endo -70.19 -19.33 34.23 Favored 'Trans proline' 0 C--N 1.343 0.28 0 N-CA-C 115.614 1.351 . . . . 25.0 115.614 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -82.44 4.95 22.16 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.703 -0.623 . . . . 25.0 112.398 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.1 m -68.55 -9.61 50.48 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 m -64.04 136.65 26.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 122.176 0.988 . . . . 25.0 112.916 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -153.02 160.26 42.97 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 103.742 -2.688 . . . . 25.0 103.742 177.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.84 -170.97 27.31 Favored Glycine 0 C--O 1.226 -0.389 0 N-CA-C 108.439 -1.865 . . . . 25.0 108.439 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.74 145.35 49.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 118.811 1.306 . . . . 25.0 112.142 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -66.57 156.98 33.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.24 1.66 2.81 Favored Glycine 0 C--O 1.224 -0.528 0 CA-C-N 114.921 -1.036 . . . . 25.0 113.114 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -76.06 140.86 70.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 121.633 -0.922 . . . . 25.0 108.848 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -92.66 -15.41 17.52 Favored 'Cis proline' 0 CA--C 1.544 0.993 0 N-CA-C 115.603 1.347 . . . . 25.0 115.603 -5.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.87 -36.3 72.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.878 1.436 . . . . 25.0 114.878 -169.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.15 30.21 7.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 105.612 -1.996 . . . . 25.0 105.612 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.57 -177.2 40.0 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 114.376 -1.284 . . . . 25.0 110.835 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -62.3 170.75 6.12 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.706 2.27 . . . . 25.0 113.445 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 159.95 31.1 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.381 -1.34 . . . . 25.0 107.381 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -61.41 139.08 58.26 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.767 -1.568 . . . . 25.0 106.767 174.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.52 -6.1 83.09 Favored Glycine 0 C--O 1.228 -0.228 0 CA-C-N 116.047 -0.524 . . . . 25.0 112.439 -173.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -126.2 11.19 7.54 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.53 -0.394 . . . . 25.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.28 -52.18 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 122.209 -0.307 . . . . 25.0 111.556 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.59 -21.52 57.74 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.75 -0.463 . . . . 25.0 109.75 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.6 p -81.94 -8.87 59.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.1 32.01 12.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.519 0.728 . . . . 25.0 110.292 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.94 36.83 24.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.557 1.317 . . . . 25.0 114.557 -176.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -119.82 133.31 55.64 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.927 0.491 . . . . 25.0 110.615 175.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.4 p -61.12 -33.08 72.81 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.126 1.158 . . . . 25.0 114.126 -175.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -66.24 -15.97 63.63 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.48 0.657 . . . . 25.0 112.076 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.698 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -117.25 14.31 14.78 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.744 -0.835 . . . . 25.0 108.744 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -71.16 -38.76 72.17 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.895 -1.128 . . . . 25.0 111.325 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.3 mp0 -71.31 -13.66 61.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.803 0.811 . . . . 25.0 109.677 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -88.02 -4.65 58.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.693 -0.854 . . . . 25.0 108.693 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -113.11 -32.58 6.28 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.842 0.682 . . . . 25.0 112.842 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -97.09 123.08 40.75 Favored 'General case' 0 CA--C 1.507 -0.71 0 O-C-N 121.534 -0.729 . . . . 25.0 109.845 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.44 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -124.96 160.94 27.75 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.193 -0.912 . . . . 25.0 110.006 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -119.01 161.14 37.97 Favored Pre-proline 0 C--N 1.317 -0.815 1 N-CA-C 100.087 -4.042 . . . . 25.0 100.087 163.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.41 -5.31 15.68 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 116.924 -1.584 . . . . 25.0 115.64 -174.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.6 t -124.64 10.73 8.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.198 0.523 . . . . 25.0 111.7 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -78.17 -30.14 48.95 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.726 -0.609 . . . . 25.0 112.474 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.0 m95 -123.74 165.4 17.33 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.536 0.208 . . . . 25.0 110.646 -177.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -68.12 128.51 36.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.79 -1.929 . . . . 25.0 105.79 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.5 mmtt -101.33 106.49 17.67 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 100.929 -3.73 . . . . 25.0 100.929 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.02 135.58 52.51 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.022 -0.99 . . . . 25.0 110.511 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -89.88 101.49 14.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.738 -1.119 . . . . 25.0 107.985 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -130.68 173.86 10.49 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.632 -1.247 . . . . 25.0 107.632 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -114.69 161.9 17.51 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.275 0.843 . . . . 25.0 113.275 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.445 HG21 ' HA ' ' A' ' 139' ' ' ALA . 71.3 p -78.15 172.49 13.47 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 106.593 -1.632 . . . . 25.0 106.593 171.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.37 -162.38 32.0 Favored Glycine 0 C--O 1.241 0.562 0 N-CA-C 110.825 -0.91 . . . . 25.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.62 129.91 34.67 Favored 'Trans proline' 0 C--N 1.345 0.382 0 CA-C-N 118.961 1.38 . . . . 25.0 114.514 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -138.71 160.11 40.44 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.6 p -106.44 152.34 23.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -135.82 100.93 4.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.475 -2.417 . . . . 25.0 104.475 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.89 106.99 18.02 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.304 -0.862 . . . . 25.0 110.446 -176.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -92.8 146.94 23.26 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.62 -0.718 . . . . 25.0 109.944 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -127.53 116.08 19.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 103.937 -2.616 . . . . 25.0 103.937 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -116.42 125.6 52.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.535 -0.757 . . . . 25.0 112.689 -173.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.4 t -87.62 5.33 40.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.314 0.578 . . . . 25.0 110.245 173.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.61 116.74 21.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.93 0.395 . . . . 25.0 110.366 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -79.84 2.88 21.47 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -178.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.92 153.18 42.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.698 -0.482 . . . . 25.0 109.698 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 156.01 39.72 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.533 0.938 . . . . 25.0 113.533 -172.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.0 t -99.64 158.91 15.43 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.215 -1.031 . . . . 25.0 108.215 174.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.91 -15.31 10.0 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.161 0.288 . . . . 25.0 111.25 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.6 t -171.89 153.21 3.18 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.939 0.4 . . . . 25.0 111.951 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -125.72 139.66 53.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 104.404 -2.443 . . . . 25.0 104.404 167.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -145.01 151.42 38.54 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.342 -0.984 . . . . 25.0 108.342 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -138.01 135.04 35.55 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.12 161.71 41.42 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 118.35 0.523 . . . . 25.0 109.973 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.34 162.59 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 113.757 1.021 . . . . 25.0 113.757 -167.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -76.74 161.23 28.66 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.648 -1.242 . . . . 25.0 107.648 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.93 157.52 40.16 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.147 -0.933 . . . . 25.0 110.202 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -67.75 -19.7 47.0 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 117.858 -0.961 . . . . 25.0 114.285 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -120.98 31.99 6.16 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 122.819 0.448 . . . . 25.0 111.64 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.72 163.99 27.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.942 0.877 . . . . 25.0 112.942 -176.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.33 101.02 11.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.433 -1.258 . . . . 25.0 110.348 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -86.5 17.35 3.89 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.828 2.158 . . . . 25.0 116.828 -169.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.8 t -125.4 6.72 7.68 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.689 0.757 . . . . 25.0 109.315 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -107.72 158.45 33.35 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.7 -1.137 . . . . 25.0 108.416 -173.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -66.53 156.12 66.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 O-C-N 121.961 0.453 . . . . 25.0 111.812 178.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -70.33 100.1 1.67 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.123 0.487 . . . . 25.0 112.033 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.6 p -93.51 152.72 18.87 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.648 -1.241 . . . . 25.0 107.648 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -66.14 -25.19 66.86 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.745 -0.597 . . . . 25.0 111.073 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.29 65.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.306 -0.861 . . . . 25.0 112.235 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.5 t -82.02 -5.51 58.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.319 0.489 . . . . 25.0 112.319 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -103.87 154.24 19.84 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 114.673 1.36 . . . . 25.0 114.673 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -94.87 95.65 8.81 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 103.013 -2.958 . . . . 25.0 103.013 163.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.97 -7.03 19.29 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.109 1.152 . . . . 25.0 114.109 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.68 118.75 73.39 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.89 -0.781 . . . . 25.0 108.89 176.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.36 141.31 42.49 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 115.403 -2.598 . . . . 25.0 111.804 179.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -89.98 -12.97 37.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.523 0.564 . . . . 25.0 112.523 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.6 m -149.11 66.11 1.03 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.488 -0.324 . . . . 25.0 111.259 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -88.99 132.52 34.69 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.749 -1.181 . . . . 25.0 109.018 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -123.03 99.19 6.25 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.664 -2.347 . . . . 25.0 104.664 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -90.27 92.06 8.76 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.418 -1.327 . . . . 25.0 107.418 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -104.48 118.17 35.94 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.979 -1.489 . . . . 25.0 106.979 177.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.84 80.53 0.4 Allowed Glycine 0 CA--C 1.503 -0.696 0 CA-C-N 115.396 -0.82 . . . . 25.0 113.48 -170.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.47 15.18 6.03 Favored Glycine 0 C--N 1.322 -0.25 0 C-N-CA 120.916 -0.659 . . . . 25.0 113.661 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.48 104.82 5.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.563 0.697 . . . . 25.0 109.689 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.38 123.23 89.26 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 106.092 -1.818 . . . . 25.0 106.092 176.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.68 161.39 44.06 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 118.352 -0.632 . . . . 25.0 113.739 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.58 26.61 3.38 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.965 -1.124 . . . . 25.0 107.965 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.13 -15.45 0.41 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.975 1.71 . . . . 25.0 111.947 -174.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -129.43 151.01 50.53 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 103.776 -2.675 . . . . 25.0 103.776 169.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.46 95.0 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 122.382 1.087 . . . . 25.0 108.633 -178.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.8 m -87.36 124.72 33.69 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -118.4 162.44 18.32 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 105.27 -2.122 . . . . 25.0 105.27 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -133.95 146.35 50.4 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 103.81 -2.663 . . . . 25.0 103.81 171.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.22 158.81 27.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.986 -1.116 . . . . 25.0 107.986 -176.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -102.13 117.0 33.86 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.119 0.262 . . . . 25.0 110.67 -177.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.5 mt -75.31 132.13 76.72 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 107.238 -1.393 . . . . 25.0 107.238 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.89 145.93 96.7 Favored 'Trans proline' 0 C--N 1.352 0.742 0 CA-C-O 121.753 0.647 . . . . 25.0 113.492 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.445 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.11 -25.83 39.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.093 -0.958 . . . . 25.0 112.48 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -84.01 9.12 13.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.697 -0.683 . . . . 25.0 110.165 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -116.0 51.26 0.97 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.837 0.827 . . . . 25.0 108.966 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.9 p -86.11 165.2 16.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.868 -1.53 . . . . 25.0 106.868 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.29 -169.09 32.83 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 114.541 0.576 . . . . 25.0 114.541 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.0 114.36 22.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.433 0.635 . . . . 25.0 111.116 -168.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.96 170.46 21.3 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.725 -0.671 . . . . 25.0 110.657 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -105.85 150.61 8.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 107.406 -1.331 . . . . 25.0 107.406 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 50.1 mt -131.45 120.21 45.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.214 -2.143 . . . . 25.0 105.214 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.78 130.07 49.64 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.453 -0.794 . . . . 25.0 109.545 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -116.66 129.74 56.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.72 140.18 48.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.154 0.978 . . . . 25.0 112.028 -177.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -114.53 117.36 30.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 106.43 -1.693 . . . . 25.0 106.43 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.08 126.49 42.28 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.5 mm -81.79 141.62 14.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.453 -0.573 . . . . 25.0 109.453 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.58 -42.39 22.37 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.767 0.712 . . . . 25.0 110.394 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.09 -24.08 65.0 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.583 0.957 . . . . 25.0 113.583 -172.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.7 p -139.32 170.54 15.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.966 0.889 . . . . 25.0 110.21 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.22 23.64 0.58 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.125 -0.943 . . . . 25.0 112.21 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -94.32 147.48 23.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.691 -0.631 . . . . 25.0 112.606 -176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.19 143.24 12.08 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.053 -2.203 . . . . 25.0 105.053 172.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -146.66 136.03 22.82 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.997 0.74 . . . . 25.0 112.997 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -93.98 114.8 27.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.524 -0.762 . . . . 25.0 111.54 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -97.05 113.37 24.91 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.21 140.71 29.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.043 -0.526 . . . . 25.0 112.051 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.5 tt -125.13 135.47 63.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.787 -1.931 . . . . 25.0 105.787 167.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -95.31 131.2 41.67 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.766 -1.198 . . . . 25.0 107.766 176.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.5 m -132.76 163.23 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 113.103 0.779 . . . . 25.0 113.103 -175.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -119.53 95.04 4.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 104.386 -2.45 . . . . 25.0 104.386 167.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.3 tp -90.03 163.96 14.7 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 112.689 0.625 . . . . 25.0 112.689 -172.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.5 p -144.33 156.74 44.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.153 -1.054 . . . . 25.0 108.153 175.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.379 -0.82 . . . . 25.0 112.416 -175.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.7 m170 . . . . . 0 N--CA 1.484 1.237 0 CA-C-O 121.372 0.606 . . . . 25.0 110.761 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.26 168.76 34.14 Favored Glycine 0 N--CA 1.451 -0.32 1 N-CA-C 100.85 -4.9 . . . . 25.0 100.85 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -146.69 162.64 38.06 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 120.374 2.087 . . . . 25.0 110.507 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -99.34 122.6 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.979 -1.119 . . . . 25.0 107.979 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -73.42 -42.95 61.41 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.801 -1.09 . . . . 25.0 109.593 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -152.62 129.56 5.61 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 106.129 -1.804 . . . . 25.0 106.129 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.67 133.37 16.49 Favored 'Cis proline' 0 CA--C 1.534 0.495 0 C-N-CA 128.577 0.657 . . . . 25.0 111.476 -0.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.52 110.72 3.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 25.0 112.409 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 156.81 38.74 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.275 -0.639 . . . . 25.0 109.275 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -56.3 -24.77 45.54 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.642 0.777 . . . . 25.0 112.656 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.99 -49.89 58.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.771 0.796 . . . . 25.0 109.066 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -66.22 -37.43 85.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.468 -0.787 . . . . 25.0 109.888 177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -63.17 -33.1 74.73 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 122.258 -0.276 . . . . 25.0 110.808 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -39.07 91.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 25.0 110.235 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.447 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -67.67 -35.92 79.76 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.565 -0.531 . . . . 25.0 109.565 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.9 mt -77.37 4.09 11.65 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.21 -0.45 . . . . 25.0 111.599 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 58.19 22.44 9.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.306 1.443 . . . . 25.0 113.265 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.1 mt -85.03 -21.09 29.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.242 -1.392 . . . . 25.0 107.242 173.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -124.04 158.16 32.81 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.2 p -136.77 175.34 9.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.112 -0.329 . . . . 25.0 110.112 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 72.11 4.91 5.17 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.423 1.638 . . . . 25.0 115.423 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -66.63 -38.26 86.55 Favored 'General case' 0 CA--C 1.501 -0.918 0 O-C-N 121.823 -0.548 . . . . 25.0 110.972 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -63.49 1.42 Allowed Glycine 0 C--O 1.218 -0.854 0 O-C-N 123.753 0.658 . . . . 25.0 112.271 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.9 t -87.81 -54.35 4.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.571 1.177 . . . . 25.0 111.37 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.445 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.2 OUTLIER -68.83 -7.01 6.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.236 -1.347 . . . . 25.0 113.82 -171.686 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.437 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.9 pt20 -91.51 0.3 57.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.848 -0.533 . . . . 25.0 111.261 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -116.02 -34.08 4.85 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.904 -0.719 . . . . 25.0 109.893 173.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -126.91 101.75 25.83 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 109.284 -0.636 . . . . 25.0 109.284 169.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.447 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 98.0 Cg_endo -73.24 -20.4 21.37 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 117.108 -1.461 . . . . 25.0 114.53 -174.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -86.17 11.87 10.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.338 0.495 . . . . 25.0 112.338 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.1 m -65.18 -12.42 50.96 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.1 130.24 28.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 122.135 0.969 . . . . 25.0 112.919 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -152.96 151.07 29.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 104.975 -2.232 . . . . 25.0 104.975 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.65 -169.38 22.89 Favored Glycine 0 C--O 1.229 -0.216 0 N-CA-C 109.755 -1.338 . . . . 25.0 109.755 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.42 147.83 49.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 118.051 0.926 . . . . 25.0 111.725 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -65.99 157.04 31.87 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.883 -1.154 . . . . 25.0 107.883 172.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.58 -4.01 1.66 Allowed Glycine 0 C--N 1.317 -0.494 0 CA-C-N 114.773 -1.103 . . . . 25.0 112.91 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -75.76 144.58 76.9 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 121.689 -0.889 . . . . 25.0 109.116 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -91.54 -17.86 14.83 Favored 'Cis proline' 0 CA--C 1.543 0.962 0 N-CA-C 116.041 1.516 . . . . 25.0 116.041 -5.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.6 -37.44 62.88 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.913 1.449 . . . . 25.0 114.913 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -116.47 32.29 6.22 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.212 -1.773 . . . . 25.0 106.212 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.59 -176.94 47.0 Favored Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 114.591 -1.186 . . . . 25.0 110.744 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.95 171.54 3.68 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.982 2.455 . . . . 25.0 113.095 177.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.11 160.07 30.9 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.726 -1.213 . . . . 25.0 107.726 174.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.75 139.62 57.14 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 106.038 -1.838 . . . . 25.0 106.038 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 106' ' ' PRO . . . 86.4 -8.02 76.33 Favored Glycine 0 C--O 1.229 -0.163 0 CA-C-N 116.403 -0.362 . . . . 25.0 112.666 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -126.18 9.5 7.37 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.396 -0.473 . . . . 25.0 111.329 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.86 -49.53 83.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 122.151 -0.343 . . . . 25.0 111.166 -174.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -20.9 57.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.98 0.419 . . . . 25.0 110.266 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -84.73 -8.57 58.79 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.995 0.739 . . . . 25.0 112.995 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 33.31 13.65 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.53 0.732 . . . . 25.0 110.043 -172.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.47 39.24 25.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.816 1.414 . . . . 25.0 114.816 -177.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -120.55 137.55 54.33 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.105 0.562 . . . . 25.0 110.714 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.0 p -62.95 -36.28 82.95 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 115.617 1.71 . . . . 25.0 115.617 -173.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 t -72.29 -5.01 33.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -177.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.702 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -121.14 12.5 11.08 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -72.23 -36.5 69.12 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.051 -1.031 . . . . 25.0 110.106 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -71.69 -11.07 60.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.496 -0.774 . . . . 25.0 109.715 175.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.0 mp -93.95 -1.3 54.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.822 -0.807 . . . . 25.0 108.822 -177.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -116.26 -32.02 5.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.567 0.58 . . . . 25.0 112.567 174.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -92.22 131.77 37.19 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 107.453 -1.314 . . . . 25.0 107.453 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.476 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.3 pm0 -137.56 160.61 38.69 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.405 -0.816 . . . . 25.0 111.443 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 52.8 p -119.99 159.57 46.42 Favored Pre-proline 0 C--O 1.242 0.667 1 N-CA-C 100.068 -4.049 . . . . 25.0 100.068 159.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -70.32 -6.37 18.72 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 116.281 -2.012 . . . . 25.0 115.558 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.2 t -114.5 2.1 14.51 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.636 0.606 . . . . 25.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -78.33 -28.13 47.26 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.088 0.773 . . . . 25.0 113.088 -175.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.476 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.5 m95 -124.5 163.13 22.5 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 120.581 0.229 . . . . 25.0 110.608 -177.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.31 129.49 40.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 106.158 -1.793 . . . . 25.0 106.158 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -101.86 107.56 18.78 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 100.231 -3.989 . . . . 25.0 100.231 177.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -68.37 134.48 50.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.242 -0.89 . . . . 25.0 110.141 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -92.63 100.78 13.23 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 25.0 108.0 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.5 mt -131.17 173.99 10.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.106 -1.072 . . . . 25.0 108.106 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.23 154.33 25.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 111.519 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.445 HG22 HD23 ' A' ' 168' ' ' LEU . 58.9 p -77.04 168.37 20.2 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 96.61 -161.86 22.2 Favored Glycine 0 C--O 1.241 0.564 0 N-CA-C 110.366 -1.094 . . . . 25.0 110.366 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.95 132.29 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 CA-C-N 119.057 1.429 . . . . 25.0 113.482 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.94 160.76 38.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.473 -1.677 . . . . 25.0 106.473 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 p -101.37 151.1 22.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.686 -1.227 . . . . 25.0 107.686 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -138.02 100.97 4.3 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.074 -2.195 . . . . 25.0 105.074 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.07 114.33 28.15 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.356 -0.838 . . . . 25.0 110.038 -176.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -101.5 150.96 22.53 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.526 -0.761 . . . . 25.0 110.631 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -126.63 116.46 21.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 104.092 -2.559 . . . . 25.0 104.092 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.76 126.64 55.64 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.547 -0.751 . . . . 25.0 110.952 -174.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.3 t -89.01 13.9 11.85 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.44 0.638 . . . . 25.0 110.565 176.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -133.68 138.75 46.03 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.94 -0.475 . . . . 25.0 109.855 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -86.09 -7.67 58.43 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.681 0.623 . . . . 25.0 112.681 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.77 157.92 31.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.4 t -76.98 156.0 32.22 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 114.809 1.411 . . . . 25.0 114.809 -172.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -97.14 159.41 14.93 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 172.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -117.81 -14.54 10.11 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 123.127 0.267 . . . . 25.0 111.263 171.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -172.19 152.85 2.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.947 0.403 . . . . 25.0 111.335 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -125.43 136.91 53.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 167.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -142.04 150.19 40.94 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.044 -1.095 . . . . 25.0 108.044 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -136.57 133.6 36.56 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.03 164.14 35.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.334 0.515 . . . . 25.0 110.595 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.91 164.81 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.331 0.863 . . . . 25.0 113.331 -166.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.6 p -81.33 162.92 23.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.286 -1.375 . . . . 25.0 107.286 168.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -61.27 157.71 42.21 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.468 -0.787 . . . . 25.0 108.996 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -69.0 -22.33 35.75 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 116.464 -1.891 . . . . 25.0 114.021 -173.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -114.05 31.9 6.24 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.322 0.49 . . . . 25.0 112.322 -173.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.506 ' HE1' ' HA ' ' A' ' 145' ' ' HIS . 5.5 p-90 -80.42 163.31 23.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.527 0.68 . . . . 25.0 110.106 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -87.28 101.08 13.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.309 -0.86 . . . . 25.0 110.324 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.19 22.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 115.253 1.575 . . . . 25.0 115.253 -174.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.1 t -118.93 1.09 11.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.565 0.697 . . . . 25.0 109.852 175.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -112.51 160.0 32.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 107.937 -1.135 . . . . 25.0 107.937 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' PRO . . . . . 0.417 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 58.1 Cg_endo -64.36 159.48 43.67 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 120.431 0.754 . . . . 25.0 112.592 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.4 mp -68.12 117.12 9.54 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 122.189 -0.32 . . . . 25.0 110.293 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.5 p -114.41 150.59 34.45 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.578 -0.897 . . . . 25.0 108.578 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.8 ptp180 -64.57 -24.9 67.75 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.977 -0.452 . . . . 25.0 111.621 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.54 72.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.699 -0.682 . . . . 25.0 111.999 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 85.0 p -88.98 -3.01 58.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.111 -0.495 . . . . 25.0 111.978 -178.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -97.28 150.81 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.941 1.46 . . . . 25.0 114.941 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.23 96.15 8.22 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 102.883 -3.006 . . . . 25.0 102.883 162.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.26 0.63 7.52 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.142 1.164 . . . . 25.0 114.142 -171.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 10.2 t -98.19 134.46 22.01 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.197 -0.668 . . . . 25.0 109.197 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 146.81 37.99 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 116.447 -1.902 . . . . 25.0 112.29 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -97.1 -6.63 34.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.995 0.426 . . . . 25.0 111.335 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 36.0 m -151.71 71.61 0.99 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -88.88 131.35 35.15 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 119.172 -1.011 . . . . 25.0 109.628 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -122.03 99.06 6.23 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 103.465 -2.791 . . . . 25.0 103.465 176.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -92.8 91.95 7.71 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.433 -1.321 . . . . 25.0 107.433 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -113.74 118.56 34.66 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.81 81.8 0.36 Allowed Glycine 0 CA--C 1.501 -0.841 0 CA-C-N 115.551 -0.749 . . . . 25.0 112.901 -170.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.47 16.06 5.24 Favored Glycine 0 C--N 1.32 -0.342 0 C-N-CA 120.931 -0.652 . . . . 25.0 113.699 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.88 104.03 4.61 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.579 0.704 . . . . 25.0 109.449 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.7 126.23 90.82 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 106.376 -1.712 . . . . 25.0 106.376 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.09 171.13 18.91 Favored 'Trans proline' 0 C--N 1.344 0.294 0 N-CA-C 113.573 0.566 . . . . 25.0 113.573 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.438 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.55 29.84 5.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.687 -1.227 . . . . 25.0 107.687 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.08 -15.04 0.35 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.894 1.678 . . . . 25.0 111.868 -173.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.438 ' H ' ' C ' ' A' ' 128' ' ' ALA . 68.4 mt-30 -129.0 154.69 46.37 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 103.416 -2.809 . . . . 25.0 103.416 170.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.4 t -140.48 94.98 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.577 0 N-CA-C 106.266 -1.753 . . . . 25.0 106.266 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.14 145.57 27.56 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 104.43 -2.433 . . . . 25.0 104.43 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.04 166.98 31.8 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.493 -1.685 . . . . 25.0 108.217 -178.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -136.14 154.3 51.02 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.95 160.55 30.92 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.769 -1.567 . . . . 25.0 106.769 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -103.38 115.55 30.76 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.018 0.199 . . . . 25.0 111.004 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.71 130.33 73.89 Favored Pre-proline 0 C--O 1.239 0.519 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.69 147.22 95.02 Favored 'Trans proline' 0 C--N 1.351 0.683 0 CA-C-O 121.729 0.637 . . . . 25.0 113.232 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.95 -24.22 38.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.188 -0.915 . . . . 25.0 112.554 -169.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.4 p-10 -85.02 9.57 14.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.65 -0.705 . . . . 25.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -113.51 56.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.864 -1.161 . . . . 25.0 107.864 170.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.2 p -86.18 170.79 11.83 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 106.968 -1.493 . . . . 25.0 106.968 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 82.25 -165.42 44.94 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 116.926 1.53 . . . . 25.0 116.926 174.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.4 t -86.04 106.47 17.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.295 0.569 . . . . 25.0 110.962 -168.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.506 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.6 p-80 -157.96 172.43 18.46 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.082 -0.508 . . . . 25.0 111.306 -176.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.8 p -102.87 150.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.786 -1.19 . . . . 25.0 107.786 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.9 mt -134.84 129.6 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 N-CA-C 101.487 -3.523 . . . . 25.0 101.487 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -120.28 139.71 52.31 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 109.78 -0.452 . . . . 25.0 109.78 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -120.6 134.26 55.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.073 -0.714 . . . . 25.0 109.073 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.25 139.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 122.165 0.983 . . . . 25.0 112.02 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -109.45 113.2 25.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.299 -1.741 . . . . 25.0 106.299 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 122.22 35.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.735 -1.209 . . . . 25.0 107.735 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.8 mm -78.52 142.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.388 -0.597 . . . . 25.0 109.388 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.23 -43.19 24.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.819 0.736 . . . . 25.0 110.224 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.01 -23.47 65.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.755 -1.111 . . . . 25.0 113.898 -172.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.0 p -139.82 170.4 15.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.045 0.926 . . . . 25.0 110.299 -175.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.6 20.04 0.96 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.115 -0.948 . . . . 25.0 112.232 177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.13 146.07 24.57 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.617 -0.677 . . . . 25.0 112.491 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.41 143.46 11.87 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.385 -2.08 . . . . 25.0 105.385 172.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -146.6 130.9 17.53 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 111.772 0.286 . . . . 25.0 111.772 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -88.95 115.76 26.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.868 -0.605 . . . . 25.0 110.663 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.02 20.67 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.691 -0.855 . . . . 25.0 108.691 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.68 143.43 33.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 25.0 112.552 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -129.0 134.94 63.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 105.135 -2.172 . . . . 25.0 105.135 166.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -94.45 130.93 40.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.84 162.26 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 112.973 0.731 . . . . 25.0 112.973 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -120.38 95.12 4.6 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.362 -2.459 . . . . 25.0 104.362 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.445 HD23 HG22 ' A' ' 74' ' ' THR . 1.9 tp -90.5 162.81 14.88 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 113.274 0.842 . . . . 25.0 113.274 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.3 p -145.26 164.42 31.46 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.72 0 CA-C-O 117.966 -1.016 . . . . 25.0 110.785 -178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.2 m80 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.328 0.585 . . . . 25.0 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.59 169.79 38.38 Favored Glycine 0 CA--C 1.508 -0.357 1 N-CA-C 102.54 -4.224 . . . . 25.0 102.54 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 p90 -144.16 160.01 41.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 119.954 1.877 . . . . 25.0 110.461 178.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.24 121.14 47.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.48 -40.94 56.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.515 -1.22 . . . . 25.0 109.972 -174.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.6 t -153.7 128.68 4.88 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 105.77 -1.937 . . . . 25.0 105.77 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.19 130.6 11.28 Favored 'Cis proline' 0 C--N 1.348 0.512 0 C-N-CA 128.554 0.648 . . . . 25.0 111.099 -0.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 114.48 5.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.106 -0.497 . . . . 25.0 112.263 -172.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.1 t -71.86 158.64 35.69 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 108.628 -0.878 . . . . 25.0 108.628 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -54.6 -26.33 31.93 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.578 0.751 . . . . 25.0 111.81 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.97 -53.45 38.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.678 0.752 . . . . 25.0 109.327 175.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.09 -34.86 78.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.733 -0.667 . . . . 25.0 110.558 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -63.45 -33.14 74.9 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 122.174 -0.329 . . . . 25.0 110.548 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -40.03 95.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.319 0.581 . . . . 25.0 109.617 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.422 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -68.3 -33.85 75.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.081 -0.509 . . . . 25.0 110.395 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.91 5.21 14.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.454 176.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 58.83 23.23 11.05 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.098 1.359 . . . . 25.0 113.053 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.44 -21.24 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.818 -1.178 . . . . 25.0 107.818 174.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.9 m-20 -124.31 160.17 28.65 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.687 -2.338 . . . . 25.0 104.687 176.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -136.42 174.8 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.247 -0.279 . . . . 25.0 110.247 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 71.8 5.26 5.31 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.917 1.821 . . . . 25.0 115.917 173.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.3 m -67.35 -35.2 78.89 Favored 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 121.555 -0.716 . . . . 25.0 111.045 174.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.4 -64.3 1.38 Allowed Glycine 0 C--O 1.217 -0.918 0 O-C-N 123.818 0.699 . . . . 25.0 112.185 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 t -87.89 -54.09 4.42 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.621 1.2 . . . . 25.0 111.176 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.73 -8.27 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.151 -1.386 . . . . 25.0 113.164 -171.591 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.81 1.75 54.73 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.976 -0.453 . . . . 25.0 111.505 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.51 -34.88 3.68 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.713 -0.795 . . . . 25.0 110.427 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -127.12 100.57 26.77 Favored Pre-proline 0 C--O 1.241 0.636 0 C-N-CA 122.132 0.173 . . . . 25.0 111.163 169.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.422 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.2 Cg_endo -74.05 -21.28 18.36 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 117.141 -1.439 . . . . 25.0 114.505 -176.241 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -83.83 11.98 6.75 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.697 0.629 . . . . 25.0 112.697 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -68.99 -16.22 63.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.739 0.304 . . . . 25.0 111.77 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.68 137.69 24.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 113.983 1.105 . . . . 25.0 113.983 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -152.97 152.99 32.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 106.156 -1.794 . . . . 25.0 106.156 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -155.34 -168.31 18.27 Favored Glycine 0 C--O 1.229 -0.206 0 N-CA-C 108.694 -1.763 . . . . 25.0 108.694 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.6 tp -127.8 147.31 50.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 118.325 1.063 . . . . 25.0 111.704 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -66.47 156.89 33.52 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 172.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 1.84 3.84 Favored Glycine 0 C--O 1.225 -0.43 0 CA-C-N 114.962 -1.017 . . . . 25.0 113.255 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.95 145.1 77.05 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 121.732 -0.864 . . . . 25.0 109.691 -176.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -91.63 -16.07 18.36 Favored 'Cis proline' 0 CA--C 1.54 0.823 0 N-CA-C 115.119 1.161 . . . . 25.0 115.119 -6.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -71.8 -35.68 70.06 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.711 1.374 . . . . 25.0 114.711 -169.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.43 30.97 6.99 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.508 -2.034 . . . . 25.0 105.508 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.31 -173.43 40.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 114.259 -1.337 . . . . 25.0 111.131 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.11 171.61 4.91 Favored 'Trans proline' 0 C--O 1.242 0.685 0 C-N-CA 123.099 2.532 . . . . 25.0 113.713 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.01 159.94 31.15 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.649 -1.612 . . . . 25.0 106.649 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.42 138.81 58.27 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.385 -1.28 . . . . 25.0 107.864 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.83 -4.32 82.89 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-O 121.408 0.449 . . . . 25.0 112.794 -174.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -124.19 10.23 8.69 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.171 -0.678 . . . . 25.0 109.171 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.0 mt -65.32 -50.16 74.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 122.361 -0.212 . . . . 25.0 111.509 -173.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.64 -20.35 58.56 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.811 -0.556 . . . . 25.0 110.124 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.0 p -83.54 -8.27 59.37 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.434 0.531 . . . . 25.0 112.434 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.42 34.02 14.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.627 0.771 . . . . 25.0 110.168 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.07 39.74 25.96 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.734 1.383 . . . . 25.0 114.734 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -120.74 134.4 55.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.174 0.59 . . . . 25.0 110.752 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -62.38 -34.34 76.51 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.698 1.37 . . . . 25.0 114.698 -175.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 t -70.49 -8.33 50.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.488 0.551 . . . . 25.0 112.488 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.693 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -120.84 13.76 11.53 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.479 -1.304 . . . . 25.0 107.479 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -72.4 -37.18 68.75 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.056 -1.028 . . . . 25.0 110.455 -176.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -71.45 -13.7 61.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.721 0.772 . . . . 25.0 109.084 174.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.693 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.3 mp -90.17 -3.78 57.66 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.673 -0.694 . . . . 25.0 109.142 -178.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -113.95 -34.21 5.5 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -92.82 119.91 32.64 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 121.596 -0.69 . . . . 25.0 110.312 -178.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.484 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.14 160.96 25.38 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.213 -0.903 . . . . 25.0 108.888 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.8 p -117.77 162.67 27.88 Favored Pre-proline 0 C--N 1.316 -0.857 1 N-CA-C 99.671 -4.196 . . . . 25.0 99.671 162.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.84 -4.91 14.29 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 116.782 -1.679 . . . . 25.0 115.687 -175.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -125.54 11.53 7.97 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.228 0.537 . . . . 25.0 111.783 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -77.46 -28.21 52.33 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.868 0.692 . . . . 25.0 112.868 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.484 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.5 m95 -125.88 165.41 18.78 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 110.145 -0.317 . . . . 25.0 110.145 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -66.87 126.54 29.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.23 -2.137 . . . . 25.0 105.23 168.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -94.86 104.89 16.79 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 100.294 -3.965 . . . . 25.0 100.294 177.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.79 134.87 54.03 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.654 -1.157 . . . . 25.0 110.098 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -93.26 99.37 11.93 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.585 -1.265 . . . . 25.0 107.585 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.9 mt -129.68 173.83 10.26 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.669 -1.975 . . . . 25.0 105.669 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -116.73 163.35 16.27 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -178.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.437 HG22 HD23 ' A' ' 168' ' ' LEU . 73.8 p -77.48 172.88 12.65 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.653 -1.612 . . . . 25.0 107.086 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.54 -162.62 31.94 Favored Glycine 0 C--O 1.24 0.479 0 N-CA-C 111.125 -0.79 . . . . 25.0 111.125 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.13 130.25 35.44 Favored 'Trans proline' 0 C--N 1.346 0.418 0 CA-C-N 118.8 1.3 . . . . 25.0 113.667 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -137.52 158.59 44.06 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.51 -1.663 . . . . 25.0 106.51 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 p -96.22 150.31 20.68 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -135.3 100.94 4.67 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 104.512 -2.403 . . . . 25.0 104.512 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.72 114.64 28.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.911 0.862 . . . . 25.0 109.521 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -100.08 146.99 26.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.3 -0.864 . . . . 25.0 109.492 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.31 114.39 18.19 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 103.624 -2.732 . . . . 25.0 103.624 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.8 mp -111.93 133.15 54.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.596 -0.729 . . . . 25.0 110.83 -172.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -99.19 17.85 18.92 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.763 0.792 . . . . 25.0 109.049 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.58 133.74 50.99 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.201 -0.666 . . . . 25.0 109.201 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -87.27 -17.21 33.06 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.535 0.939 . . . . 25.0 113.535 -177.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.1 162.05 29.91 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.956 0.724 . . . . 25.0 112.956 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -66.41 155.93 36.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 116.508 2.04 . . . . 25.0 116.508 -170.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 8.2 t -101.37 158.98 15.66 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.694 -1.225 . . . . 25.0 107.694 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -117.94 -17.22 9.79 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.302 0.482 . . . . 25.0 112.302 172.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.9 t -171.09 154.38 4.06 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.503 0.556 . . . . 25.0 112.503 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.8 m95 -128.8 140.71 51.58 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 104.64 -2.355 . . . . 25.0 104.64 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.6 mtt-85 -147.43 151.7 36.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.39 -0.967 . . . . 25.0 108.39 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -137.93 138.72 39.27 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.114 -1.439 . . . . 25.0 107.114 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.66 162.77 39.56 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.284 0.493 . . . . 25.0 109.92 176.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.99 164.96 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 114.275 1.213 . . . . 25.0 114.275 -167.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 11.0 p -79.6 161.65 25.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.226 -1.027 . . . . 25.0 108.226 169.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.65 157.47 47.7 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.116 -0.947 . . . . 25.0 109.621 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.77 -18.44 36.96 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 117.444 -1.237 . . . . 25.0 114.072 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.73 31.93 6.21 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 122.791 0.436 . . . . 25.0 111.566 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -74.25 162.88 28.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.847 0.832 . . . . 25.0 111.434 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -83.64 101.06 11.24 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.736 -1.12 . . . . 25.0 110.172 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -84.81 14.09 5.16 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 116.597 2.073 . . . . 25.0 116.597 -171.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -117.93 1.91 12.1 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.833 -0.802 . . . . 25.0 108.833 175.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -105.09 158.48 32.0 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 107.832 -1.173 . . . . 25.0 107.832 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -66.65 159.44 51.0 Favored 'Trans proline' 0 C--N 1.344 0.327 0 O-C-N 122.024 0.486 . . . . 25.0 112.232 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.96 101.9 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 25.0 110.641 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.6 p -98.63 159.76 14.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.449 -0.945 . . . . 25.0 108.449 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -65.42 -25.76 67.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.097 0.475 . . . . 25.0 110.964 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -24.97 61.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.648 -0.706 . . . . 25.0 112.277 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.7 m -79.29 -12.1 59.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.754 0.311 . . . . 25.0 111.82 -178.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 42.2 m-85 -99.17 155.04 17.68 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.16 1.541 . . . . 25.0 115.16 -174.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -94.43 95.63 8.98 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 102.619 -3.104 . . . . 25.0 102.619 163.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.9 mt -69.79 20.89 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 116.428 2.011 . . . . 25.0 116.428 -169.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.0 t -114.3 137.39 22.52 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.272 -0.64 . . . . 25.0 109.272 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.77 152.07 46.91 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.208 -2.728 . . . . 25.0 111.196 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -107.9 -6.69 16.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.972 0.415 . . . . 25.0 111.688 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.5 m -152.6 70.06 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.133 -0.485 . . . . 25.0 109.911 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -89.06 135.06 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.239 -0.984 . . . . 25.0 109.172 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.01 99.12 5.98 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.765 -2.309 . . . . 25.0 104.765 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -93.24 92.06 7.55 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.931 -0.766 . . . . 25.0 108.931 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -107.42 117.06 33.1 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.671 -1.233 . . . . 25.0 107.671 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.55 80.58 0.37 Allowed Glycine 0 CA--C 1.503 -0.703 0 CA-C-N 115.799 -0.637 . . . . 25.0 113.519 -170.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.43 15.87 5.8 Favored Glycine 0 C--N 1.322 -0.237 0 C-N-CA 120.96 -0.638 . . . . 25.0 113.264 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.48 105.59 4.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.358 0.599 . . . . 25.0 109.585 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 88.8 mt -72.29 122.59 87.83 Favored Pre-proline 0 C--N 1.321 -0.673 0 N-CA-C 105.384 -2.08 . . . . 25.0 105.384 175.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.94 167.24 26.55 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 117.864 -0.957 . . . . 25.0 113.826 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.4 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -96.32 25.8 4.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.291 -1.003 . . . . 25.0 108.291 175.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.65 -12.36 0.46 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.822 1.649 . . . . 25.0 112.168 -174.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 128' ' ' ALA . 63.7 mt-30 -130.12 152.2 49.83 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.046 -2.576 . . . . 25.0 104.046 169.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.1 t -142.94 95.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.843 -1.54 . . . . 25.0 106.843 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -86.94 141.09 28.97 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.199 -2.148 . . . . 25.0 105.199 174.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.52 167.0 26.53 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.513 -2.032 . . . . 25.0 105.513 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -134.08 152.02 51.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.04 -2.208 . . . . 25.0 105.04 172.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.3 160.33 35.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.441 -1.318 . . . . 25.0 107.441 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -103.43 116.0 31.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.597 -0.274 . . . . 25.0 111.018 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 131.24 72.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -60.91 144.21 99.52 Favored 'Trans proline' 0 C--N 1.352 0.726 0 N-CA-C 113.919 0.7 . . . . 25.0 113.919 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.23 -28.2 42.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.182 -0.917 . . . . 25.0 112.514 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -82.35 10.25 7.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.733 0.778 . . . . 25.0 110.133 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -117.78 53.43 0.94 Allowed 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.553 -1.277 . . . . 25.0 107.553 171.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.95 11.82 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 106.398 -1.704 . . . . 25.0 106.398 174.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.95 -165.15 41.47 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 116.262 1.265 . . . . 25.0 116.262 176.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -86.02 108.61 18.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.446 0.641 . . . . 25.0 111.012 -168.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.408 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 44.0 p-80 -159.39 172.36 18.07 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.784 -0.644 . . . . 25.0 110.921 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -109.06 152.04 11.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.219 -1.03 . . . . 25.0 108.219 -179.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 67.8 mt -134.44 123.22 42.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 104.229 -2.508 . . . . 25.0 104.229 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.54 127.7 52.33 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 122.899 0.479 . . . . 25.0 110.261 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -111.54 129.36 56.08 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 108.816 -0.809 . . . . 25.0 108.816 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.7 p -126.72 139.75 50.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 122.172 0.987 . . . . 25.0 111.92 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 9.7 t90 -117.13 124.12 48.4 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.56 126.52 49.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.597 -0.52 . . . . 25.0 109.597 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 35.9 mm -77.85 142.47 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.93 -45.55 20.25 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.929 0.786 . . . . 25.0 110.678 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.17 -21.25 64.9 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.575 1.324 . . . . 25.0 114.575 -172.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 50.0 p -138.59 169.09 18.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.915 0.864 . . . . 25.0 109.577 -175.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.7 19.67 0.81 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.257 -0.883 . . . . 25.0 112.244 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.1 142.65 27.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -176.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.46 141.1 14.46 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 171.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -140.81 135.41 31.4 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.501 0.556 . . . . 25.0 112.501 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -93.65 112.47 24.35 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.449 -0.796 . . . . 25.0 111.149 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -97.15 108.21 20.89 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.971 -0.752 . . . . 25.0 108.971 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.11 141.75 33.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.744 -0.662 . . . . 25.0 111.737 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -125.27 132.88 70.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 105.553 -2.017 . . . . 25.0 105.553 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -96.46 129.42 43.83 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.3 162.31 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.666 0.987 . . . . 25.0 113.666 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.49 94.93 4.73 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.652 -2.721 . . . . 25.0 103.652 164.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.437 HD23 HG22 ' A' ' 74' ' ' THR . 2.9 tp -91.29 156.86 17.49 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 112.844 0.683 . . . . 25.0 112.844 -170.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.4 p -145.76 168.06 21.65 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.998 -0.439 . . . . 25.0 110.886 175.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.767 0 CA-C-O 118.711 -0.661 . . . . 25.0 110.602 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 121.012 0.434 . . . . 25.0 110.548 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.92 169.4 33.9 Favored Glycine 0 CA--C 1.509 -0.327 1 N-CA-C 101.872 -4.491 . . . . 25.0 101.872 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -145.75 161.49 39.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 120.188 1.994 . . . . 25.0 110.278 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -97.99 122.96 50.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.809 -1.182 . . . . 25.0 107.809 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -73.19 -43.34 61.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.999 -1.001 . . . . 25.0 109.424 -176.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.7 t -153.29 131.36 6.33 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.16 -1.793 . . . . 25.0 106.16 177.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.96 134.18 19.1 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.498 0.624 . . . . 25.0 111.395 -0.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.26 109.83 2.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.001 -0.545 . . . . 25.0 112.239 -172.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.6 t -71.94 157.55 37.63 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.947 -0.76 . . . . 25.0 108.947 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -55.86 -24.36 36.34 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.439 0.695 . . . . 25.0 111.812 178.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.54 -53.28 36.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.711 0.767 . . . . 25.0 109.279 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.01 -37.18 85.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.489 -0.778 . . . . 25.0 110.277 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -62.97 -32.82 74.23 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 120.991 -0.284 . . . . 25.0 110.814 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.05 94.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.086 0.47 . . . . 25.0 110.53 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.468 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.0 tmtm? -70.07 -33.42 71.9 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.05 0.452 . . . . 25.0 110.047 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.65 3.62 11.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.481 174.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.03 10.09 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.39 1.476 . . . . 25.0 113.05 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.8 mt -85.86 -22.28 27.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.196 -1.409 . . . . 25.0 107.196 173.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 34.5 m-20 -123.3 158.78 30.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 105.004 -2.221 . . . . 25.0 105.004 176.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.6 p -135.95 177.76 7.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.463 -0.569 . . . . 25.0 109.463 -176.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 72.02 4.97 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.498 1.666 . . . . 25.0 115.498 173.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.4 m -69.95 -37.15 75.76 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.484 -0.76 . . . . 25.0 111.647 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.22 -63.5 1.72 Allowed Glycine 0 C--O 1.219 -0.838 0 O-C-N 123.474 0.484 . . . . 25.0 112.192 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.0 t -88.04 -53.33 4.78 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.392 1.092 . . . . 25.0 111.544 -178.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.9 OUTLIER -68.4 -10.56 13.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.447 -1.251 . . . . 25.0 113.054 -171.723 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -87.71 2.28 51.54 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.902 -0.499 . . . . 25.0 112.101 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -120.07 -34.74 3.62 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.756 -0.778 . . . . 25.0 110.677 172.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.05 105.32 22.32 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.288 -0.634 . . . . 25.0 109.288 169.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.468 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 86.9 Cg_endo -76.1 -20.23 14.93 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 116.326 -1.983 . . . . 25.0 114.16 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -85.0 12.11 8.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.555 0.576 . . . . 25.0 112.555 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -68.79 -12.13 61.15 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.859 0.361 . . . . 25.0 111.966 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.09 133.65 29.52 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.877 0.846 . . . . 25.0 112.734 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -152.85 153.93 34.08 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.882 -1.525 . . . . 25.0 106.882 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.53 -172.43 26.69 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 109.339 -1.504 . . . . 25.0 109.339 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.4 tp -124.28 151.49 44.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.848 0.824 . . . . 25.0 111.774 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -64.26 156.99 27.15 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.772 -1.196 . . . . 25.0 107.772 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.17 -2.68 3.25 Favored Glycine 0 C--O 1.223 -0.565 0 CA-C-N 114.517 -1.22 . . . . 25.0 113.028 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -75.76 138.89 69.89 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 121.407 -1.054 . . . . 25.0 110.522 -175.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -92.71 -15.76 16.73 Favored 'Cis proline' 0 CA--C 1.543 0.955 0 N-CA-C 115.609 1.35 . . . . 25.0 115.609 -6.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -71.05 -35.35 71.92 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.412 1.634 . . . . 25.0 115.412 -168.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.07 32.74 5.71 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.938 -1.875 . . . . 25.0 105.938 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.21 -174.28 40.57 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 114.407 -1.27 . . . . 25.0 111.496 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.98 170.87 4.28 Favored 'Trans proline' 0 C--O 1.241 0.637 0 C-N-CA 123.212 2.608 . . . . 25.0 113.359 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.13 159.96 31.03 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.2 -1.407 . . . . 25.0 107.2 174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.86 139.19 58.04 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.424 -1.262 . . . . 25.0 107.96 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.39 -5.66 76.34 Favored Glycine 0 C--O 1.23 -0.12 0 CA-C-O 121.704 0.613 . . . . 25.0 112.874 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 20.3 m170 -126.43 9.21 7.18 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 71.4 mt -65.96 -49.7 74.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.276 -0.265 . . . . 25.0 111.161 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.17 -21.26 58.89 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.842 -0.536 . . . . 25.0 109.774 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -83.4 -6.58 59.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.758 0.651 . . . . 25.0 112.758 -178.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.78 32.6 12.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.544 0.738 . . . . 25.0 110.209 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.45 35.78 22.97 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.636 1.347 . . . . 25.0 114.636 -177.258 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -120.56 141.19 50.51 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.999 0.52 . . . . 25.0 111.743 176.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -65.35 -35.27 80.47 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.0 -6.85 45.13 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.348 0.594 . . . . 25.0 112.353 -177.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.675 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -120.45 12.66 11.66 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 107.226 -1.398 . . . . 25.0 107.226 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -71.77 -36.02 70.23 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.893 -1.129 . . . . 25.0 110.112 -175.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -71.38 -14.47 62.18 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.834 0.826 . . . . 25.0 109.967 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.675 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.9 mp -87.48 -7.59 57.44 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.405 -0.961 . . . . 25.0 108.405 -178.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -112.35 -31.99 6.65 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 120.959 0.409 . . . . 25.0 112.006 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -94.94 122.1 37.23 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 121.66 -0.65 . . . . 25.0 109.898 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.439 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -130.0 160.97 32.02 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.423 -0.955 . . . . 25.0 108.423 177.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.4 p -117.05 163.6 22.32 Favored Pre-proline 0 C--N 1.32 -0.71 1 N-CA-C 99.778 -4.156 . . . . 25.0 99.778 162.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -2.29 9.46 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 116.473 -1.885 . . . . 25.0 115.936 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.4 t -128.03 11.1 6.5 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.512 0.673 . . . . 25.0 111.831 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -79.12 -29.19 43.05 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.179 -0.951 . . . . 25.0 113.549 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.439 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.2 m95 -125.71 166.88 15.97 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.957 -0.386 . . . . 25.0 109.957 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -66.55 118.58 10.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.842 -1.54 . . . . 25.0 106.842 172.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -92.4 103.65 16.06 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 100.624 -3.843 . . . . 25.0 100.624 176.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.18 135.03 53.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.8 -1.091 . . . . 25.0 110.195 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -92.88 99.96 12.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.562 -1.199 . . . . 25.0 107.799 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.8 mt -131.7 173.95 10.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.558 -1.645 . . . . 25.0 106.558 -175.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -114.79 163.22 15.81 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.929 1.085 . . . . 25.0 113.929 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.431 HG21 ' HA ' ' A' ' 139' ' ' ALA . 74.5 p -76.96 168.58 19.86 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.71 -161.14 24.7 Favored Glycine 0 C--O 1.24 0.514 0 N-CA-C 110.619 -0.993 . . . . 25.0 110.619 -178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.85 131.11 41.87 Favored 'Trans proline' 0 C--N 1.346 0.443 0 CA-C-N 119.1 1.45 . . . . 25.0 114.437 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -140.07 159.71 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.816 -1.55 . . . . 25.0 106.816 178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 p -105.84 150.9 25.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.751 -1.204 . . . . 25.0 107.751 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -137.34 100.89 4.37 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 105.083 -2.191 . . . . 25.0 105.083 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.03 116.83 32.73 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.909 0.862 . . . . 25.0 109.811 -176.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -103.26 150.54 23.63 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.635 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -127.76 115.41 18.64 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 103.964 -2.606 . . . . 25.0 103.964 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -116.04 124.38 50.31 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.009 0.744 . . . . 25.0 113.009 -172.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.1 t -88.23 -1.93 58.3 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.05 0.452 . . . . 25.0 110.59 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.16 119.97 37.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.4 mmm180 -84.3 -0.13 51.28 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.925 1.454 . . . . 25.0 114.925 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.13 155.39 39.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 117.741 0.246 . . . . 25.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.6 t -74.14 155.95 37.87 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 114.879 1.437 . . . . 25.0 114.879 -171.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 7.3 t -90.73 162.61 14.82 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.01 -0.995 . . . . 25.0 108.552 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -117.89 -14.52 10.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.922 -0.769 . . . . 25.0 108.922 168.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 t -175.2 154.41 1.75 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.006 0.431 . . . . 25.0 111.213 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.1 m95 -116.99 130.65 56.83 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.861 -2.644 . . . . 25.0 103.861 165.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 53.0 mtt-85 -133.59 147.46 51.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.953 -1.128 . . . . 25.0 107.953 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -137.37 132.24 33.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 106.627 -1.62 . . . . 25.0 106.627 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.99 164.86 33.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.368 0.531 . . . . 25.0 110.69 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 167.99 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 113.249 0.833 . . . . 25.0 113.249 -167.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.3 p -83.76 161.5 20.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.879 -1.156 . . . . 25.0 107.879 168.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -61.88 158.19 44.92 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.159 -0.928 . . . . 25.0 109.796 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.79 -18.34 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 117.557 -1.162 . . . . 25.0 114.739 -173.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -120.84 31.71 6.29 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.166 0.432 . . . . 25.0 112.166 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -76.34 165.17 25.23 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.653 0.74 . . . . 25.0 110.889 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -87.54 101.02 13.22 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.167 -0.924 . . . . 25.0 110.272 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -79.09 18.54 0.64 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 115.749 1.759 . . . . 25.0 115.749 -174.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -117.77 -2.46 11.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.328 -0.619 . . . . 25.0 109.328 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -101.67 157.4 33.75 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.367 -0.833 . . . . 25.0 108.91 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -66.63 157.66 59.77 Favored 'Trans proline' 0 C--N 1.346 0.441 0 O-C-N 121.94 0.442 . . . . 25.0 112.233 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.64 105.45 4.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.507 0.67 . . . . 25.0 111.174 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 68.3 p -99.34 157.07 16.66 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.008 -0.738 . . . . 25.0 109.008 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -65.95 -26.13 67.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.139 0.495 . . . . 25.0 110.873 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.96 -24.99 60.86 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.506 -0.77 . . . . 25.0 112.239 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.1 t -83.44 -11.1 57.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.985 0.421 . . . . 25.0 111.54 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -94.18 156.71 16.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.715 1.006 . . . . 25.0 113.715 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -97.21 96.12 8.21 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 102.826 -3.027 . . . . 25.0 102.826 162.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.37 -7.54 32.24 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.711 1.004 . . . . 25.0 113.711 -171.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.76 122.7 78.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 108.124 -1.065 . . . . 25.0 108.124 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.91 139.79 36.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.362 -2.625 . . . . 25.0 111.996 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -87.7 -15.56 36.77 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.392 0.516 . . . . 25.0 112.392 -175.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.5 m -149.31 66.68 1.02 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.427 -0.351 . . . . 25.0 110.668 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -89.09 139.23 30.68 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 118.426 -1.31 . . . . 25.0 109.336 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -118.19 100.93 7.84 Favored 'General case' 0 CA--C 1.496 -1.113 0 N-CA-C 101.225 -3.62 . . . . 25.0 101.225 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -88.56 92.12 9.07 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 105.571 -2.011 . . . . 25.0 105.571 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.83 117.64 33.36 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.736 -1.579 . . . . 25.0 106.736 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.97 81.12 0.51 Allowed Glycine 0 CA--C 1.5 -0.855 0 CA-C-N 115.441 -0.8 . . . . 25.0 111.798 -173.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.21 16.85 5.54 Favored Glycine 0 C--N 1.32 -0.33 0 C-N-CA 120.86 -0.686 . . . . 25.0 114.283 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.87 104.18 5.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.629 -0.878 . . . . 25.0 108.629 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -75.84 127.56 85.24 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 107.54 -1.281 . . . . 25.0 107.54 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.44 153.77 60.79 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 117.985 -0.877 . . . . 25.0 113.842 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -98.8 30.88 3.14 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.982 -1.488 . . . . 25.0 106.982 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 72.74 -18.8 0.33 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.041 1.737 . . . . 25.0 111.705 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -129.23 151.51 49.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 104.941 -2.244 . . . . 25.0 104.941 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 47.6 t -144.08 95.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.495 -1.298 . . . . 25.0 107.495 -178.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -91.42 133.7 35.25 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 163.22 31.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 104.975 -2.231 . . . . 25.0 104.975 177.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -136.93 149.62 47.71 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 105.341 -2.096 . . . . 25.0 105.341 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 163.95 31.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.668 -1.234 . . . . 25.0 107.668 -178.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -102.01 118.78 37.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.439 0.162 . . . . 25.0 111.125 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.4 mt -76.25 132.23 73.69 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -63.34 147.53 93.54 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-O 121.692 0.622 . . . . 25.0 113.576 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.03 -26.15 43.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.25 -0.886 . . . . 25.0 112.769 -169.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -82.09 7.24 13.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.602 0.715 . . . . 25.0 110.113 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -114.44 52.29 0.84 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 107.812 -1.181 . . . . 25.0 107.812 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.92 11.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.041 -1.836 . . . . 25.0 106.041 173.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.68 -168.65 41.94 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 116.116 1.206 . . . . 25.0 116.116 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.15 109.14 18.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.45 0.643 . . . . 25.0 110.881 -169.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.461 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.8 p-80 -158.24 171.32 20.41 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.91 -0.586 . . . . 25.0 111.406 -176.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.7 p -102.92 150.2 6.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 107.315 -1.365 . . . . 25.0 107.315 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.1 mt -133.21 127.81 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 102.201 -3.259 . . . . 25.0 102.201 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.0 mp -119.96 141.27 49.81 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.848 -0.614 . . . . 25.0 109.657 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.59 140.43 52.12 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.987 -0.745 . . . . 25.0 108.987 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -127.32 135.84 62.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.059 0.933 . . . . 25.0 112.325 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.404 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.7 t90 -95.11 111.43 23.25 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.876 -2.268 . . . . 25.0 104.876 170.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -98.16 119.33 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 -177.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.6 mm -86.44 141.35 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -170.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -83.52 -46.53 12.34 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.348 0.594 . . . . 25.0 110.848 175.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.16 -27.05 66.09 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.788 1.403 . . . . 25.0 114.788 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.2 p -138.06 164.29 29.47 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.172 -0.677 . . . . 25.0 109.172 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -77.85 26.79 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.621 0.971 . . . . 25.0 113.621 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -96.05 148.96 22.12 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.574 -0.704 . . . . 25.0 112.59 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.41 138.24 9.73 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 106.373 -1.714 . . . . 25.0 106.373 170.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -146.86 131.45 17.79 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.242 0.474 . . . . 25.0 112.204 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -91.18 118.01 30.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.156 -0.475 . . . . 25.0 111.449 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -96.99 113.92 25.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.423 -0.954 . . . . 25.0 108.423 178.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.47 142.95 27.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.746 -0.661 . . . . 25.0 112.713 -175.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.47 136.77 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.032 -2.21 . . . . 25.0 105.032 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -97.17 131.58 43.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.68 162.83 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 113.049 0.759 . . . . 25.0 113.049 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -120.06 95.07 4.6 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 167.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.424 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.86 161.09 15.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.158 0.799 . . . . 25.0 113.158 -171.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 66.0 p -145.85 166.45 25.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.83 -0.804 . . . . 25.0 108.83 175.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.755 0 CA-C-O 118.827 -0.606 . . . . 25.0 110.408 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.6 m80 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.471 0.653 . . . . 25.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.5 170.87 38.9 Favored Glycine 0 CA--C 1.509 -0.307 1 N-CA-C 101.282 -4.727 . . . . 25.0 101.282 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -141.72 154.92 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 120.144 1.972 . . . . 25.0 109.787 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.31 119.61 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 106.019 -1.845 . . . . 25.0 106.019 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.32 -44.61 36.05 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.314 -1.312 . . . . 25.0 110.338 -172.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -148.46 124.55 5.27 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -64.65 131.4 12.08 Favored 'Cis proline' 0 CA--C 1.536 0.617 0 C-N-CA 128.7 0.708 . . . . 25.0 111.766 -0.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.84 112.51 4.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -173.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 t -71.98 158.42 36.03 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.576 -0.528 . . . . 25.0 109.576 -178.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -55.33 -25.43 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.714 0.806 . . . . 25.0 112.08 178.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.33 -51.47 52.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.64 0.733 . . . . 25.0 109.296 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.13 -37.03 84.7 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.719 -0.673 . . . . 25.0 109.977 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.7 -32.46 73.56 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 122.344 -0.223 . . . . 25.0 110.97 178.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -40.82 96.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.559 . . . . 25.0 110.323 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.438 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.6 tmtm? -68.15 -34.44 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.27 0.557 . . . . 25.0 109.812 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.7 mt -78.0 6.58 7.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.043 -0.526 . . . . 25.0 111.681 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 59.15 23.19 11.43 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.218 1.407 . . . . 25.0 113.342 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.2 mt -90.09 -21.08 22.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.491 -0.929 . . . . 25.0 108.491 174.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.54 159.97 28.01 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 106.097 -1.816 . . . . 25.0 106.097 178.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 p -135.69 174.59 10.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.566 0.347 . . . . 25.0 111.126 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 66.93 4.99 3.78 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 116.855 2.169 . . . . 25.0 116.855 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -64.89 -38.99 92.83 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 121.664 -0.648 . . . . 25.0 111.261 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.57 1.58 Allowed Glycine 0 C--O 1.217 -0.948 0 O-C-N 123.733 0.646 . . . . 25.0 111.92 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 t -88.07 -52.27 5.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.574 1.178 . . . . 25.0 110.994 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -7.13 7.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.33 -1.305 . . . . 25.0 113.53 -171.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -90.74 -0.74 57.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.851 -0.531 . . . . 25.0 111.302 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -116.39 -34.02 4.75 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.259 -0.577 . . . . 25.0 109.748 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.94 102.44 24.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.461 -0.57 . . . . 25.0 109.461 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.438 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 92.6 Cg_endo -74.37 -20.54 18.34 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 117.383 -1.278 . . . . 25.0 113.955 -174.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -87.03 14.96 6.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.432 0.53 . . . . 25.0 112.432 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 61.5 m -65.09 -21.33 66.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.989 0.424 . . . . 25.0 111.651 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.67 125.96 22.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 115.274 1.583 . . . . 25.0 115.274 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -152.93 159.77 42.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.127 -1.805 . . . . 25.0 106.127 172.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.01 -167.47 21.51 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 107.661 -2.176 . . . . 25.0 107.661 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -119.33 150.67 39.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 118.31 1.055 . . . . 25.0 111.916 -177.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -65.29 152.85 42.74 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.089 -1.448 . . . . 25.0 107.089 172.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.14 2.07 1.65 Allowed Glycine 0 C--N 1.317 -0.498 0 CA-C-N 115.091 -0.958 . . . . 25.0 114.153 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -75.97 140.64 70.5 Favored Pre-proline 0 C--N 1.322 -0.619 0 O-C-N 121.605 -0.938 . . . . 25.0 109.369 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -93.23 -13.45 20.46 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 C-N-CA 130.473 1.447 . . . . 25.0 115.607 -6.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.84 -37.42 76.17 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.489 1.292 . . . . 25.0 114.489 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.48 30.5 7.26 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.57 -179.93 44.83 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 114.384 -1.28 . . . . 25.0 110.79 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -62.54 173.35 3.6 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.985 2.457 . . . . 25.0 113.356 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 160.04 31.05 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 107.207 -1.405 . . . . 25.0 107.207 173.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -60.66 139.69 57.75 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 107.204 -1.406 . . . . 25.0 107.204 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.51 -5.89 79.35 Favored Glycine 0 CA--C 1.511 -0.184 0 CA-C-N 116.232 -0.44 . . . . 25.0 112.628 -174.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -124.97 8.86 8.08 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.517 -0.402 . . . . 25.0 109.954 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.32 -49.48 80.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 122.047 -0.408 . . . . 25.0 111.502 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.33 -16.96 59.64 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.992 -0.442 . . . . 25.0 110.102 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.7 p -87.28 -7.56 57.71 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.02 30.89 10.14 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.521 0.729 . . . . 25.0 110.464 -172.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.97 37.25 24.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.357 1.243 . . . . 25.0 114.357 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.2 135.71 54.89 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.938 0.495 . . . . 25.0 110.807 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 p -61.44 -34.78 76.0 Favored 'General case' 0 C--O 1.213 -0.827 0 N-CA-C 114.627 1.343 . . . . 25.0 114.627 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -69.2 -8.56 46.86 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -178.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -122.68 12.48 9.92 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 108.123 -1.065 . . . . 25.0 108.123 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -70.71 -39.58 73.36 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.901 -1.125 . . . . 25.0 111.176 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -73.38 -11.06 60.35 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.697 0.761 . . . . 25.0 109.423 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.1 mp -88.14 -3.09 58.93 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.768 -0.826 . . . . 25.0 108.768 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -114.11 -34.02 5.5 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.973 0.416 . . . . 25.0 111.357 172.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -86.6 116.1 24.5 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 121.78 -0.575 . . . . 25.0 110.375 -178.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.462 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.8 pm0 -125.46 160.9 28.31 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.401 0.619 . . . . 25.0 110.658 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.1 p -119.88 160.22 43.56 Favored Pre-proline 0 C--N 1.317 -0.816 1 N-CA-C 99.719 -4.178 . . . . 25.0 99.719 160.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.17 -2.63 10.79 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 N-CA-C 116.094 1.536 . . . . 25.0 116.094 -173.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -121.21 9.76 10.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.182 0.515 . . . . 25.0 111.361 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -79.65 -28.66 40.84 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.243 0.831 . . . . 25.0 113.243 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.2 m95 -126.6 168.35 14.43 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.773 0.321 . . . . 25.0 111.259 -176.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -69.6 119.38 13.75 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 106.75 -1.574 . . . . 25.0 106.75 171.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.3 mmtt -93.29 103.08 15.35 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 101.183 -3.636 . . . . 25.0 101.183 177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.79 135.58 55.07 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.917 -1.038 . . . . 25.0 110.621 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -89.69 102.41 15.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.177 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.6 173.85 10.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.577 -1.268 . . . . 25.0 107.577 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.16 157.36 24.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.937 -0.574 . . . . 25.0 111.243 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 139' ' ' ALA . 76.4 p -76.96 168.83 19.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 106.877 -1.527 . . . . 25.0 106.877 171.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.93 -160.93 26.56 Favored Glycine 0 C--O 1.239 0.468 0 N-CA-C 110.424 -1.071 . . . . 25.0 110.424 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.95 131.51 42.16 Favored 'Trans proline' 0 C--N 1.347 0.449 0 CA-C-N 119.061 1.43 . . . . 25.0 114.177 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -137.91 161.94 35.34 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 106.7 -1.592 . . . . 25.0 106.7 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.8 p -103.39 149.49 24.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.392 -1.336 . . . . 25.0 107.392 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -137.57 101.06 4.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.042 -2.207 . . . . 25.0 105.042 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.8 113.99 27.87 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.224 1.011 . . . . 25.0 110.046 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -95.48 146.94 24.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.028 -0.987 . . . . 25.0 108.697 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -124.97 114.45 19.15 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 103.655 -2.72 . . . . 25.0 103.655 179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.12 138.51 48.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.477 -0.783 . . . . 25.0 110.037 -173.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.0 t -101.0 14.53 31.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.241 1.02 . . . . 25.0 109.136 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.5 134.85 29.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.899 -0.591 . . . . 25.0 110.079 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -90.1 5.65 45.87 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.588 0.588 . . . . 25.0 112.588 -179.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.79 153.25 42.38 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.904 -0.406 . . . . 25.0 109.904 178.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 t -74.36 156.07 37.47 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.264 1.209 . . . . 25.0 114.264 -170.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -102.93 157.42 16.99 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -118.01 -14.93 9.97 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 111.541 0.2 . . . . 25.0 111.541 173.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.5 t -172.45 154.26 3.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.975 0.417 . . . . 25.0 111.897 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -126.63 139.05 53.47 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 104.3 -2.481 . . . . 25.0 104.3 167.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 16.8 mtt-85 -144.9 150.61 37.34 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.446 -0.946 . . . . 25.0 108.446 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -137.69 136.22 37.2 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.333 -1.728 . . . . 25.0 106.333 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -148.52 162.43 39.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.515 0.598 . . . . 25.0 110.022 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.99 166.0 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 113.478 0.918 . . . . 25.0 113.478 -167.197 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 13.2 p -80.98 162.39 23.86 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.688 -1.227 . . . . 25.0 107.688 169.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -62.39 158.39 48.58 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.31 -0.859 . . . . 25.0 108.994 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.03 -23.33 34.25 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 116.565 -1.823 . . . . 25.0 114.272 -173.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -113.87 32.06 6.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.576 0.351 . . . . 25.0 111.499 -175.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.4 p-90 -76.14 164.31 26.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.98 0.895 . . . . 25.0 112.541 -176.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -83.04 100.93 10.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.523 -1.217 . . . . 25.0 110.101 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.09 12.88 10.43 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.662 2.097 . . . . 25.0 116.662 -170.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.7 t -121.08 7.91 10.35 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.561 -0.903 . . . . 25.0 108.561 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.22 159.52 32.51 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 107.388 -1.338 . . . . 25.0 107.388 -174.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 158.04 57.04 Favored 'Trans proline' 0 C--N 1.346 0.435 0 O-C-N 121.894 0.418 . . . . 25.0 113.08 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.59 106.32 3.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.898 0.38 . . . . 25.0 110.522 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -103.42 153.66 20.26 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.808 -0.812 . . . . 25.0 108.808 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -64.69 -25.14 67.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.0 0.429 . . . . 25.0 111.484 177.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.12 64.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.623 -0.717 . . . . 25.0 112.221 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.1 t -80.66 -21.06 41.74 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.632 0.73 . . . . 25.0 110.983 -178.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 26.1 m-85 -86.56 152.1 22.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 115.2 1.555 . . . . 25.0 115.2 -176.267 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -95.67 92.82 6.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 102.692 -3.077 . . . . 25.0 102.692 163.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.42 -6.25 13.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -170.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -84.93 131.68 48.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.66 140.91 27.07 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 115.779 -2.347 . . . . 25.0 112.369 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -92.16 -11.87 34.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.382 0.512 . . . . 25.0 112.382 -177.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.4 m -148.98 66.75 1.04 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.503 0.321 . . . . 25.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -88.99 133.52 34.3 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 118.357 -1.337 . . . . 25.0 109.027 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -118.89 99.08 6.52 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 102.715 -3.069 . . . . 25.0 102.715 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -91.53 91.95 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.446 -1.687 . . . . 25.0 106.446 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -110.45 117.28 33.15 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.808 -1.182 . . . . 25.0 107.808 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.01 78.67 0.87 Allowed Glycine 0 CA--C 1.502 -0.772 0 CA-C-N 115.072 -0.967 . . . . 25.0 113.787 -169.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.59 22.21 6.82 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 121.015 -0.612 . . . . 25.0 113.906 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.67 106.71 4.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.802 0.811 . . . . 25.0 109.284 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.32 122.87 88.3 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.975 -1.121 . . . . 25.0 107.975 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -77.92 168.36 22.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 N-CA-C 114.633 0.974 . . . . 25.0 114.633 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -109.21 33.26 4.38 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.83 -18.36 0.31 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.823 1.649 . . . . 25.0 112.76 -177.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -128.58 152.8 47.91 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 104.823 -2.288 . . . . 25.0 104.823 168.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -140.49 95.02 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.0 m -94.85 122.75 37.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.109 -1.441 . . . . 25.0 107.109 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.69 167.05 19.44 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 105.73 -1.952 . . . . 25.0 105.73 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -130.31 151.0 51.29 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.256 -2.128 . . . . 25.0 105.256 175.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 160.5 38.4 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.219 -1.401 . . . . 25.0 107.219 -177.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -103.28 115.8 31.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.091 0.245 . . . . 25.0 111.072 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.29 132.45 73.14 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 107.508 -1.293 . . . . 25.0 107.508 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.47 146.74 96.79 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-O 121.699 0.625 . . . . 25.0 113.519 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.96 -24.91 37.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.219 -0.9 . . . . 25.0 112.658 -168.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -85.46 10.42 12.97 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.622 0.725 . . . . 25.0 110.103 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -116.53 53.53 0.88 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 171.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -85.99 170.97 11.8 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 84.95 -168.3 42.98 Favored Glycine 0 C--N 1.321 -0.295 0 N-CA-C 116.157 1.223 . . . . 25.0 116.157 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.5 t -85.9 108.87 18.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 25.0 111.097 -168.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.425 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 50.0 p-80 -157.46 171.38 20.48 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.993 -0.548 . . . . 25.0 111.388 -176.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.42 151.04 7.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 107.963 -1.125 . . . . 25.0 107.963 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -133.79 122.45 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -106.54 133.39 51.3 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.71 -0.677 . . . . 25.0 109.921 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.24 135.32 53.33 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 122.939 0.495 . . . . 25.0 110.227 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.96 145.87 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 122.13 0.967 . . . . 25.0 112.901 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -113.63 112.95 24.36 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.929 -1.878 . . . . 25.0 105.929 172.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.3 122.27 35.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.707 -1.22 . . . . 25.0 107.707 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 15.5 mm -79.14 141.72 14.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.153 -0.684 . . . . 25.0 109.153 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.32 -42.34 23.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.75 0.704 . . . . 25.0 109.845 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.88 -23.87 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.75 1.018 . . . . 25.0 113.75 -172.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 49.0 p -138.8 169.65 17.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.867 0.841 . . . . 25.0 110.149 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.92 19.01 0.91 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.308 -0.86 . . . . 25.0 112.356 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.05 146.17 24.53 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.26 0.837 . . . . 25.0 113.26 -175.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.65 143.19 11.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 105.291 -2.114 . . . . 25.0 105.291 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -148.06 128.35 13.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 111.632 0.234 . . . . 25.0 111.632 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -86.82 118.34 26.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.032 0.444 . . . . 25.0 110.679 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -96.99 115.44 27.43 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.258 -1.016 . . . . 25.0 108.258 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.7 142.38 29.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.131 -0.486 . . . . 25.0 111.921 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -127.15 136.22 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 105.1 -2.185 . . . . 25.0 105.1 166.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -97.02 130.63 44.31 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.054 -1.461 . . . . 25.0 107.054 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.17 162.5 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 113.101 0.778 . . . . 25.0 113.101 -174.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.67 94.99 4.66 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 104.382 -2.451 . . . . 25.0 104.382 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.54 163.76 14.48 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.4 p -145.9 164.09 33.08 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.954 -1.128 . . . . 25.0 107.954 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-O 117.74 -1.124 . . . . 25.0 111.536 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 121.086 0.469 . . . . 25.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.67 170.88 22.99 Favored Glycine 0 CA--C 1.509 -0.342 1 N-CA-C 101.652 -4.579 . . . . 25.0 101.652 -175.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -146.62 163.16 36.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 120.297 2.049 . . . . 25.0 110.687 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -97.86 121.87 48.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -41.79 53.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.624 -1.171 . . . . 25.0 109.863 -174.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.64 129.3 5.17 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 106.018 -1.845 . . . . 25.0 106.018 176.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -64.46 132.25 13.62 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 128.751 0.73 . . . . 25.0 111.093 -0.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.78 112.61 4.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.038 -0.528 . . . . 25.0 111.855 -172.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.8 t -71.93 158.34 36.2 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 108.185 -1.043 . . . . 25.0 108.185 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -55.57 -24.77 34.49 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.304 0.642 . . . . 25.0 112.049 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.17 -53.78 33.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.819 0.819 . . . . 25.0 109.43 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -67.65 -35.09 78.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.505 -0.77 . . . . 25.0 110.564 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.68 -33.0 74.66 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.111 -0.368 . . . . 25.0 110.734 178.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -40.79 98.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.347 0.594 . . . . 25.0 109.555 177.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -67.85 -35.03 77.85 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.215 0.531 . . . . 25.0 110.185 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.69 5.47 9.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 25.0 111.436 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 59.1 24.95 13.32 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.097 1.359 . . . . 25.0 112.78 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.1 mt -91.14 -21.84 20.98 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.131 -1.063 . . . . 25.0 108.131 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -124.06 159.9 28.88 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.011 -1.848 . . . . 25.0 106.011 178.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.2 p -134.73 175.49 9.5 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 122.261 0.225 . . . . 25.0 110.508 -176.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 70.21 5.08 5.15 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.574 1.694 . . . . 25.0 115.574 175.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.9 m -66.66 -38.49 86.95 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 121.412 -0.805 . . . . 25.0 110.565 172.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.63 -63.94 1.48 Allowed Glycine 0 C--O 1.218 -0.861 0 O-C-N 123.754 0.659 . . . . 25.0 112.114 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.3 t -88.06 -52.82 5.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.423 1.106 . . . . 25.0 111.098 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.64 -9.97 12.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.697 -1.138 . . . . 25.0 113.54 -171.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.97 -3.06 58.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.857 -0.527 . . . . 25.0 111.266 177.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -116.25 -34.02 4.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.456 -0.572 . . . . 25.0 109.456 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -126.9 97.67 32.24 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 109.989 -0.375 . . . . 25.0 109.989 173.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -74.97 -20.73 16.65 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 118.041 -0.839 . . . . 25.0 113.956 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -84.14 11.01 8.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.471 0.545 . . . . 25.0 112.471 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.7 m -64.83 -22.57 67.02 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.448 0.536 . . . . 25.0 112.448 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 9.1 m -64.04 121.42 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 115.12 1.526 . . . . 25.0 115.12 -173.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -152.82 158.54 42.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 106.517 -1.66 . . . . 25.0 106.517 174.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.47 -166.18 18.76 Favored Glycine 0 N--CA 1.453 -0.209 0 N-CA-C 108.094 -2.003 . . . . 25.0 108.094 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -120.02 148.67 43.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.382 1.091 . . . . 25.0 112.079 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.39 157.0 33.0 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 171.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.25 2.02 1.64 Allowed Glycine 0 C--O 1.224 -0.493 0 CA-C-N 114.802 -1.09 . . . . 25.0 113.766 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -75.94 139.31 69.47 Favored Pre-proline 0 C--N 1.322 -0.622 0 O-C-N 121.576 -0.955 . . . . 25.0 110.067 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -93.45 -14.8 17.08 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 C-N-CA 130.35 1.396 . . . . 25.0 115.613 -6.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -70.98 -35.82 72.27 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.936 1.458 . . . . 25.0 114.936 -168.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -121.39 31.63 6.24 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 105.553 -2.018 . . . . 25.0 105.553 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.48 -177.61 41.45 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 114.389 -1.278 . . . . 25.0 111.749 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.3 172.5 3.26 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 123.505 2.803 . . . . 25.0 113.498 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 160.01 31.03 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.141 -1.429 . . . . 25.0 107.141 173.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -61.21 139.13 58.19 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.249 -1.389 . . . . 25.0 107.249 175.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.06 86.37 Favored Glycine 0 C--O 1.228 -0.275 0 CA-C-N 116.079 -0.51 . . . . 25.0 112.593 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -125.58 9.58 7.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.906 -0.775 . . . . 25.0 108.906 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.38 -49.51 74.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 122.132 -0.355 . . . . 25.0 111.631 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.1 -25.39 59.77 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.637 -0.505 . . . . 25.0 109.637 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.4 p -79.85 -9.77 59.7 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.181 0.437 . . . . 25.0 112.181 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.37 34.4 14.93 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.857 0.863 . . . . 25.0 109.984 -172.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.23 39.26 25.95 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.951 1.463 . . . . 25.0 114.951 -177.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -120.16 134.63 55.21 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.992 0.517 . . . . 25.0 110.614 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -61.68 -35.76 78.9 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 115.368 1.618 . . . . 25.0 115.368 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.03 -7.18 44.6 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.308 0.575 . . . . 25.0 112.456 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.7 m-85 -121.74 13.47 10.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -72.14 -37.29 69.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.192 -0.942 . . . . 25.0 110.841 -175.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.7 mp0 -69.81 -17.02 63.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.85 0.833 . . . . 25.0 109.802 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.26 -5.47 59.32 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.902 -0.777 . . . . 25.0 108.902 -177.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.55 -32.82 6.34 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.561 0.578 . . . . 25.0 112.561 173.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -97.61 119.49 36.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 O-C-N 121.458 -0.776 . . . . 25.0 110.629 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.475 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -123.92 160.95 26.39 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.383 -0.826 . . . . 25.0 109.596 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -117.29 162.48 27.91 Favored Pre-proline 0 C--N 1.317 -0.824 1 N-CA-C 99.908 -4.108 . . . . 25.0 99.908 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.33 -5.34 15.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 116.559 -1.828 . . . . 25.0 115.763 -174.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.25 10.38 9.29 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.177 0.513 . . . . 25.0 111.77 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -78.8 -28.77 44.62 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.042 0.756 . . . . 25.0 113.042 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.475 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.1 m95 -126.94 165.41 19.46 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 120.787 0.327 . . . . 25.0 110.463 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.58 131.41 45.95 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 105.959 -1.867 . . . . 25.0 105.959 170.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -101.2 106.85 18.11 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 101.06 -3.681 . . . . 25.0 101.06 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.21 136.18 51.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.952 -1.022 . . . . 25.0 110.329 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -90.23 104.04 16.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.802 -1.09 . . . . 25.0 108.478 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.3 mt -129.92 173.91 10.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.542 -1.281 . . . . 25.0 107.542 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.59 157.64 24.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.768 -0.651 . . . . 25.0 111.472 -174.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 69.6 p -77.04 169.52 18.18 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.154 -1.425 . . . . 25.0 107.154 172.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.2 -161.69 27.93 Favored Glycine 0 C--O 1.239 0.413 0 N-CA-C 110.702 -0.959 . . . . 25.0 110.702 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.88 132.2 46.28 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 119.012 1.406 . . . . 25.0 113.964 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -137.26 160.88 37.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.289 -1.745 . . . . 25.0 106.289 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.5 p -104.84 152.03 23.09 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.53 -1.285 . . . . 25.0 107.53 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -139.15 101.06 4.18 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.37 -2.085 . . . . 25.0 105.37 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.1 113.45 26.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.977 0.894 . . . . 25.0 109.924 -178.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -99.59 145.13 27.88 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.184 -0.917 . . . . 25.0 110.055 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -123.19 108.91 13.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.968 -2.234 . . . . 25.0 104.968 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -104.83 135.46 46.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.601 -0.727 . . . . 25.0 109.86 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.7 t -101.28 17.67 21.96 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.723 0.773 . . . . 25.0 109.95 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.29 141.35 33.94 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.992 -0.744 . . . . 25.0 108.992 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -85.29 -4.85 59.3 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.662 0.615 . . . . 25.0 112.662 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.85 155.13 31.51 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.564 0.579 . . . . 25.0 112.564 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -74.39 155.83 37.68 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -173.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.446 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 9.8 t -99.09 157.94 16.0 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.013 -1.106 . . . . 25.0 108.013 173.694 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -117.75 -16.62 10.0 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.738 0.273 . . . . 25.0 111.738 172.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 t -171.91 152.44 2.99 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.869 0.366 . . . . 25.0 111.886 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -124.95 139.63 53.65 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.389 -2.449 . . . . 25.0 104.389 167.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -144.56 148.67 34.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.128 -1.064 . . . . 25.0 108.128 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.95 134.69 35.24 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.64 161.37 42.31 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.364 0.529 . . . . 25.0 110.187 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 163.15 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.52 0.933 . . . . 25.0 113.52 -167.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 p -77.46 161.15 28.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.811 -1.181 . . . . 25.0 107.811 171.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -61.44 157.24 47.28 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.044 -0.98 . . . . 25.0 109.16 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.89 -23.6 34.75 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.95 -1.566 . . . . 25.0 114.13 -172.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -113.36 32.01 6.07 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 122.621 0.368 . . . . 25.0 111.544 -174.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -78.7 163.68 25.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.838 0.827 . . . . 25.0 111.587 -177.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -87.86 100.98 13.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.844 -1.071 . . . . 25.0 110.393 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -78.85 21.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 116.158 1.91 . . . . 25.0 116.158 -173.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -120.74 -0.78 10.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.37 0.605 . . . . 25.0 109.826 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -101.64 156.49 35.13 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.376 -0.829 . . . . 25.0 108.806 -176.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.39 158.27 57.84 Favored 'Trans proline' 0 C--N 1.346 0.437 0 O-C-N 121.882 0.411 . . . . 25.0 111.525 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.99 97.61 1.91 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.324 0.583 . . . . 25.0 112.105 -176.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.7 p -91.87 152.94 19.85 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.474 -0.935 . . . . 25.0 108.474 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -65.26 -25.48 67.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.246 0.546 . . . . 25.0 111.049 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.87 -27.1 66.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.419 -0.81 . . . . 25.0 112.295 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 t -84.65 -5.87 59.33 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.054 0.391 . . . . 25.0 112.054 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -100.7 154.21 18.8 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 114.105 1.15 . . . . 25.0 114.105 -175.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -94.59 93.92 7.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 102.633 -3.099 . . . . 25.0 102.633 163.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.34 -7.3 23.6 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -169.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.8 t -83.68 128.31 64.18 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 176.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.71 146.51 48.79 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 115.278 -2.682 . . . . 25.0 111.336 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -97.11 -10.23 26.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.979 0.419 . . . . 25.0 111.527 -177.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.3 m -148.97 67.25 1.04 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.57 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -88.98 132.33 34.77 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 118.967 -1.093 . . . . 25.0 108.79 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -124.41 98.98 5.98 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 104.738 -2.319 . . . . 25.0 104.738 177.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -92.55 92.16 7.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -103.74 117.61 34.78 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 107.278 -1.379 . . . . 25.0 107.278 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -97.71 78.35 0.63 Allowed Glycine 0 CA--C 1.504 -0.636 0 CA-C-N 115.447 -0.797 . . . . 25.0 114.021 -169.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 112.3 22.0 6.01 Favored Glycine 0 C--N 1.321 -0.28 0 C-N-CA 120.817 -0.706 . . . . 25.0 113.203 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.68 107.03 5.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.531 0.681 . . . . 25.0 109.363 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.06 123.0 88.61 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 106.036 -1.838 . . . . 25.0 106.036 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.91 171.6 17.69 Favored 'Trans proline' 0 C--N 1.345 0.343 0 N-CA-C 113.715 0.621 . . . . 25.0 113.715 -175.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.11 27.27 5.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.581 -0.896 . . . . 25.0 108.581 176.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.56 -17.77 0.27 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.716 1.607 . . . . 25.0 112.365 -174.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 128' ' ' ALA . 67.5 mt-30 -127.23 153.33 46.24 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 103.494 -2.78 . . . . 25.0 103.494 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 69.5 t -141.41 95.08 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.604 0 N-CA-C 106.263 -1.754 . . . . 25.0 106.263 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.5 t -85.96 143.79 27.98 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 103.557 -2.757 . . . . 25.0 103.557 172.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.04 167.0 29.86 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.933 -1.485 . . . . 25.0 107.59 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -134.67 156.05 49.44 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.654 -1.61 . . . . 25.0 106.654 174.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.6 160.34 25.71 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.098 -1.445 . . . . 25.0 107.098 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -104.75 116.96 32.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.054 0.222 . . . . 25.0 110.979 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.86 132.12 68.66 Favored Pre-proline 0 CA--C 1.54 0.576 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -61.96 147.94 94.14 Favored 'Trans proline' 0 C--N 1.352 0.716 0 CA-C-O 121.652 0.605 . . . . 25.0 113.474 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.57 -26.54 34.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.32 -0.855 . . . . 25.0 112.594 -169.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -83.6 10.1 9.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.602 0.715 . . . . 25.0 110.305 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.3 mmt-85 -116.34 50.0 1.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.568 -0.901 . . . . 25.0 108.568 172.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 35.9 p -86.0 164.94 17.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.672 -1.603 . . . . 25.0 106.672 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.97 -167.94 31.0 Favored Glycine 0 N--CA 1.451 -0.339 0 N-CA-C 115.043 0.777 . . . . 25.0 115.043 177.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -85.99 111.03 19.89 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.369 0.604 . . . . 25.0 110.908 -168.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.427 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 48.5 p-80 -159.14 171.08 20.59 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 115.913 -0.585 . . . . 25.0 111.241 -176.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.0 p -104.75 150.5 7.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.6 mt -132.24 120.99 45.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.83 131.53 52.19 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.394 -0.821 . . . . 25.0 109.62 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -123.59 133.14 54.0 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.519 -0.549 . . . . 25.0 109.519 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.46 143.78 36.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 122.073 0.939 . . . . 25.0 112.356 -178.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.446 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.8 t90 -113.8 113.22 24.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.872 -1.899 . . . . 25.0 105.872 173.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.64 125.74 38.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.981 -1.118 . . . . 25.0 107.981 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.6 mm -80.71 142.1 14.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.901 -0.777 . . . . 25.0 108.901 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.53 -43.49 22.99 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 118.806 0.73 . . . . 25.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.2 -23.24 64.81 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.749 1.018 . . . . 25.0 113.749 -172.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.1 p -138.63 168.76 19.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.962 0.887 . . . . 25.0 110.022 -175.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.88 21.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.216 -0.902 . . . . 25.0 112.313 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -91.63 145.27 24.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.076 0.769 . . . . 25.0 113.076 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.55 143.58 13.29 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 105.106 -2.183 . . . . 25.0 105.106 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -148.55 129.77 14.62 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.137 0.421 . . . . 25.0 112.137 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -85.53 117.37 24.39 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 121.105 0.479 . . . . 25.0 111.063 177.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -97.12 108.19 20.87 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.318 -1.364 . . . . 25.0 107.318 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.16 142.76 30.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.829 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -126.9 136.1 61.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 105.424 -2.065 . . . . 25.0 105.424 168.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -97.02 129.11 44.52 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.51 163.07 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.157 0.799 . . . . 25.0 113.157 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -117.83 95.28 4.85 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 103.994 -2.595 . . . . 25.0 103.994 166.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.6 tp -89.94 163.04 15.12 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 120.909 0.385 . . . . 25.0 111.652 -172.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.0 p -145.85 158.03 43.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 118.113 -0.946 . . . . 25.0 111.368 -178.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.0 m170 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 110.599 -0.149 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.23 166.09 11.89 Favored Glycine 0 N--CA 1.459 0.217 1 N-CA-C 102.758 -4.137 . . . . 25.0 102.758 -174.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.2 p90 -149.38 168.12 24.27 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.444 2.122 . . . . 25.0 111.921 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -103.82 124.37 58.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.565 -1.272 . . . . 25.0 107.565 176.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.89 -43.18 30.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.922 -1.036 . . . . 25.0 109.968 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -152.89 129.8 5.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.923 -1.88 . . . . 25.0 105.923 176.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.76 130.79 9.84 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.933 0.806 . . . . 25.0 111.451 0.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.76 4.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.875 -0.602 . . . . 25.0 112.11 -172.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.7 t -72.14 157.34 37.93 Favored 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 108.667 -0.864 . . . . 25.0 108.667 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -55.2 -25.61 33.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.726 0.81 . . . . 25.0 111.924 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.26 30.21 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.824 0.821 . . . . 25.0 109.157 175.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -66.48 -35.74 81.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.498 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.3 -33.36 75.35 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 122.157 -0.34 . . . . 25.0 110.849 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -39.79 94.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.225 0.536 . . . . 25.0 109.862 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -68.21 -35.19 77.59 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.226 0.536 . . . . 25.0 110.034 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -77.77 4.4 11.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 25.0 111.278 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 58.95 22.39 10.29 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.175 1.39 . . . . 25.0 112.975 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.55 -21.69 26.76 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 174.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -123.75 158.81 30.84 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 105.435 -2.061 . . . . 25.0 105.435 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.3 p -135.81 176.95 8.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.439 -0.578 . . . . 25.0 109.439 -176.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 71.3 5.13 5.33 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.442 1.645 . . . . 25.0 115.442 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -68.76 -38.13 79.87 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 121.53 -0.732 . . . . 25.0 110.821 174.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.8 -63.62 1.55 Allowed Glycine 0 C--O 1.217 -0.924 0 O-C-N 123.713 0.633 . . . . 25.0 112.116 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.8 t -88.0 -53.31 4.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 122.503 1.144 . . . . 25.0 111.643 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.9 OUTLIER -68.28 -11.11 13.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.563 -1.199 . . . . 25.0 113.239 -171.881 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -86.91 -2.71 58.81 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.751 -0.593 . . . . 25.0 111.479 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -116.25 -34.11 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.129 -0.628 . . . . 25.0 109.594 173.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -126.9 92.44 44.55 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 120.926 0.393 . . . . 25.0 111.463 171.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.401 ' HA ' HG12 ' A' ' 25' ' ' VAL . 85.6 Cg_endo -74.15 -19.13 20.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 117.66 -1.093 . . . . 25.0 114.022 -176.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.99 5.38 41.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.231 0.456 . . . . 25.0 112.231 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -2.28 24.33 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.993 0.738 . . . . 25.0 112.993 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.3 m -64.08 138.03 23.76 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 N-CA-C 113.343 0.868 . . . . 25.0 113.343 -177.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -153.02 152.28 31.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.345 -0.843 . . . . 25.0 108.779 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.58 -176.35 33.58 Favored Glycine 0 N--CA 1.452 -0.256 0 N-CA-C 107.346 -2.302 . . . . 25.0 107.346 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.84 150.3 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 118.364 1.082 . . . . 25.0 111.758 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.52 156.98 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.602 -1.258 . . . . 25.0 107.602 172.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.82 -1.74 3.57 Favored Glycine 0 C--O 1.224 -0.504 0 CA-C-N 114.756 -1.111 . . . . 25.0 112.797 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -75.98 142.1 72.22 Favored Pre-proline 0 C--N 1.322 -0.617 0 O-C-N 121.546 -0.973 . . . . 25.0 109.374 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -91.89 -13.74 23.15 Favored 'Cis proline' 0 CA--C 1.541 0.87 0 C-N-CA 130.065 1.277 . . . . 25.0 115.227 -6.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -70.71 -37.81 73.57 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.782 1.401 . . . . 25.0 114.782 -169.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.79 34.95 5.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.118 -1.808 . . . . 25.0 106.118 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.45 -174.41 46.06 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 114.613 -1.176 . . . . 25.0 111.311 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -59.8 173.71 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 124.257 3.305 . . . . 25.0 113.049 176.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.95 159.92 31.22 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.915 -1.513 . . . . 25.0 106.915 173.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -61.03 139.36 58.08 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.24 -5.05 81.98 Favored Glycine 0 C--O 1.228 -0.224 0 CA-C-N 116.06 -0.518 . . . . 25.0 112.826 -174.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -124.2 10.88 8.74 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.26 -0.644 . . . . 25.0 109.26 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.63 -49.96 74.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 122.272 -0.267 . . . . 25.0 111.291 -174.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.39 -24.66 59.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.709 -0.478 . . . . 25.0 109.709 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 p -80.45 -9.74 59.75 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.269 0.47 . . . . 25.0 112.269 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.28 34.43 14.73 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.689 0.795 . . . . 25.0 110.267 -172.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.55 41.16 26.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.467 1.284 . . . . 25.0 114.467 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -121.31 136.26 54.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.345 0.658 . . . . 25.0 110.529 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -63.5 -35.26 79.89 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -175.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.03 -7.12 47.01 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.621 0.6 . . . . 25.0 112.621 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.689 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.4 m-85 -120.13 13.58 12.1 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 107.14 -1.43 . . . . 25.0 107.14 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.54 -35.71 68.1 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.998 -1.064 . . . . 25.0 110.604 -175.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 -69.26 -17.37 63.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.923 0.868 . . . . 25.0 109.646 174.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.689 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.44 -5.36 59.18 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.485 -0.78 . . . . 25.0 109.007 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -113.97 -32.6 6.01 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.284 0.476 . . . . 25.0 112.284 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -91.65 115.89 28.42 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 121.583 -0.698 . . . . 25.0 110.34 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -125.17 161.02 27.79 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.149 -0.686 . . . . 25.0 109.149 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -116.55 163.96 20.2 Favored Pre-proline 0 C--N 1.317 -0.827 0 N-CA-C 100.348 -3.945 . . . . 25.0 100.348 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.88 -4.04 12.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 116.74 -1.707 . . . . 25.0 115.86 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -127.98 12.52 6.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.355 0.598 . . . . 25.0 111.506 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -76.6 -28.8 56.28 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.283 0.846 . . . . 25.0 113.283 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.4 m95 -126.14 167.12 15.83 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 120.598 0.237 . . . . 25.0 110.557 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -66.68 119.86 12.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.815 -1.921 . . . . 25.0 105.815 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -94.0 103.5 15.58 Favored 'General case' 0 CA--C 1.5 -0.975 1 N-CA-C 100.094 -4.039 . . . . 25.0 100.094 177.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.31 135.05 54.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.926 -1.034 . . . . 25.0 110.312 -176.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -90.4 101.09 13.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.648 -1.16 . . . . 25.0 108.296 -177.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -129.38 173.89 10.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.673 -1.232 . . . . 25.0 107.673 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.25 155.36 25.21 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 25.0 111.709 -174.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.414 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.9 p -76.99 167.99 20.87 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 172.047 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.1 -160.89 25.18 Favored Glycine 0 C--O 1.24 0.487 0 N-CA-C 110.609 -0.997 . . . . 25.0 110.609 -178.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.99 133.62 54.67 Favored 'Trans proline' 0 C--N 1.346 0.446 0 CA-C-N 119.019 1.41 . . . . 25.0 113.931 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -138.79 160.74 38.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.797 -1.557 . . . . 25.0 106.797 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -103.1 151.12 22.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.329 -1.359 . . . . 25.0 107.329 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -138.57 101.04 4.25 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 105.455 -2.054 . . . . 25.0 105.455 -177.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.61 116.45 32.09 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.949 0.88 . . . . 25.0 109.132 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -104.07 150.37 24.35 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.218 -0.901 . . . . 25.0 109.794 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -127.79 111.67 13.91 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.0 mp -109.22 122.36 47.16 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.633 -0.712 . . . . 25.0 111.71 -173.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.5 17.69 4.39 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.479 0.657 . . . . 25.0 111.227 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.33 140.37 33.77 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 121.615 -0.678 . . . . 25.0 110.133 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -82.55 -8.55 59.6 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.852 -0.613 . . . . 25.0 112.025 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -63.8 156.18 28.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -175.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.6 t -83.36 155.99 23.25 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 114.239 1.2 . . . . 25.0 114.239 -171.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -99.65 157.22 16.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.876 -0.602 . . . . 25.0 109.469 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -117.94 -14.22 10.03 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.559 0.207 . . . . 25.0 111.559 172.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.1 t -172.61 150.31 2.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.807 0.337 . . . . 25.0 111.824 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -122.86 139.5 53.95 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 104.521 -2.4 . . . . 25.0 104.521 166.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -144.75 151.83 39.45 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.454 -1.313 . . . . 25.0 107.454 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.94 134.39 34.89 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.75 -1.945 . . . . 25.0 105.75 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 164.01 34.72 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.345 0.52 . . . . 25.0 109.881 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.92 164.28 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 113.481 0.919 . . . . 25.0 113.481 -167.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -78.65 162.36 26.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -62.07 157.77 49.78 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.264 -0.88 . . . . 25.0 109.065 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.33 -25.34 36.31 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 116.534 -1.844 . . . . 25.0 114.036 -173.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -113.0 31.99 6.03 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.694 0.397 . . . . 25.0 110.882 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.67 165.02 25.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.031 0.919 . . . . 25.0 112.982 -175.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -83.1 100.93 10.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.496 -1.229 . . . . 25.0 109.857 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -88.14 12.2 14.28 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 116.693 2.109 . . . . 25.0 116.693 -169.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.4 t -119.23 6.45 11.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 176.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -109.71 156.62 39.44 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.666 -1.152 . . . . 25.0 108.042 -174.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.53 156.85 64.39 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 O-C-N 121.942 0.443 . . . . 25.0 111.847 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.05 105.17 3.24 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.28 0.562 . . . . 25.0 112.075 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.0 p -98.64 154.82 17.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.772 -0.825 . . . . 25.0 108.772 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -65.0 -26.05 68.12 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.913 -0.492 . . . . 25.0 111.484 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.84 -26.95 65.41 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.702 -0.681 . . . . 25.0 112.112 176.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 35.3 t -83.34 -5.39 59.13 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -101.96 153.7 19.63 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -94.86 95.42 8.66 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 102.556 -3.128 . . . . 25.0 102.556 163.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.1 mt -67.06 -6.81 18.79 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -169.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.1 t -86.95 131.28 45.42 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.951 -0.759 . . . . 25.0 108.951 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -72.64 149.63 49.36 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 115.54 -2.506 . . . . 25.0 111.446 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -99.62 -12.07 20.39 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.151 0.426 . . . . 25.0 112.151 -177.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.7 m -147.47 65.86 1.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.366 -0.379 . . . . 25.0 110.357 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -88.99 135.87 33.32 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 118.458 -1.297 . . . . 25.0 109.176 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -123.19 99.13 6.2 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 103.406 -2.813 . . . . 25.0 103.406 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -91.83 92.06 8.2 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 106.535 -1.654 . . . . 25.0 106.535 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -109.91 119.32 38.97 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 107.984 -1.117 . . . . 25.0 107.984 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.64 77.94 0.82 Allowed Glycine 0 CA--C 1.503 -0.713 0 CA-C-N 115.33 -0.85 . . . . 25.0 113.844 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.98 23.56 6.39 Favored Glycine 0 C--N 1.32 -0.306 0 C-N-CA 120.899 -0.667 . . . . 25.0 114.08 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.06 105.89 4.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.792 0.806 . . . . 25.0 110.005 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 87.7 mt -69.97 127.06 92.67 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 106.596 -1.631 . . . . 25.0 106.596 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.17 169.73 21.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 N-CA-C 113.998 0.73 . . . . 25.0 113.998 -176.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.417 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.89 30.86 4.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.784 -1.191 . . . . 25.0 107.784 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.61 -21.02 0.22 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.997 1.719 . . . . 25.0 111.969 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.417 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.7 mt-30 -126.64 156.56 40.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 104.219 -2.512 . . . . 25.0 104.219 169.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -138.96 95.07 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.134 -2.173 . . . . 25.0 105.134 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.7 t -87.84 139.98 29.97 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.936 -2.616 . . . . 25.0 103.936 174.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -152.62 166.93 30.55 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 113.883 -1.508 . . . . 25.0 108.779 -175.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -135.44 155.89 49.8 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.058 -1.83 . . . . 25.0 106.058 174.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.06 161.32 25.27 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.019 -1.474 . . . . 25.0 107.019 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -105.89 118.65 37.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.992 0.182 . . . . 25.0 110.868 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.2 131.9 61.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -61.99 147.2 95.62 Favored 'Trans proline' 0 C--N 1.353 0.784 0 CA-C-O 121.615 0.59 . . . . 25.0 113.456 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.414 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.75 -25.69 35.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 25.0 112.526 -169.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -83.58 9.74 10.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.684 0.754 . . . . 25.0 110.192 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.99 52.97 0.88 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.4 p -86.0 166.92 15.51 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.983 -1.488 . . . . 25.0 106.983 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.74 -166.76 34.43 Favored Glycine 0 C--O 1.238 0.389 0 N-CA-C 115.926 1.131 . . . . 25.0 115.926 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.0 t -86.01 107.6 17.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.436 0.636 . . . . 25.0 110.813 -168.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -157.93 171.27 20.56 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.774 -0.648 . . . . 25.0 110.871 -176.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.57 149.98 7.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.64 -1.245 . . . . 25.0 107.64 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.99 127.71 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 101.665 -3.458 . . . . 25.0 101.665 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.92 132.0 56.81 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.711 -0.477 . . . . 25.0 109.711 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -110.92 128.69 55.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.6 p -122.29 137.93 54.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.991 0.9 . . . . 25.0 111.014 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.4 t90 -115.71 116.19 27.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.783 -1.553 . . . . 25.0 107.008 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.3 126.91 40.93 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.959 -1.126 . . . . 25.0 107.959 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 18.8 mm -82.6 140.96 15.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.19 -43.07 29.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.824 0.738 . . . . 25.0 110.014 176.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.36 -23.59 64.7 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 114.092 1.145 . . . . 25.0 114.092 -172.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.4 p -138.78 169.76 17.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.993 0.901 . . . . 25.0 110.118 -174.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.28 19.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.142 -0.935 . . . . 25.0 112.491 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -90.04 146.99 23.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.852 0.686 . . . . 25.0 112.852 -176.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.03 141.74 15.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 104.576 -2.379 . . . . 25.0 104.576 170.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -146.39 134.79 21.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.262 0.467 . . . . 25.0 112.262 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -91.56 115.1 27.77 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.918 0.762 . . . . 25.0 110.808 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -97.05 108.1 20.76 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.446 -1.316 . . . . 25.0 107.446 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.38 139.99 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.377 -0.829 . . . . 25.0 111.757 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 132.86 70.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 105.311 -2.107 . . . . 25.0 105.311 167.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -94.02 130.41 40.16 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.981 -1.489 . . . . 25.0 106.981 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.4 m -131.81 161.35 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.912 0.708 . . . . 25.0 112.912 -175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -117.71 95.0 4.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 103.654 -2.721 . . . . 25.0 103.654 166.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.4 HD23 HG22 ' A' ' 74' ' ' THR . 2.8 tp -89.93 161.27 16.0 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.086 0.47 . . . . 25.0 111.825 -171.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.2 p -145.86 164.29 32.41 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.815 -0.809 . . . . 25.0 108.815 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.707 0 CA-C-O 118.041 -0.98 . . . . 25.0 110.378 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.9 m80 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.246 0.546 . . . . 25.0 110.372 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.41 177.53 35.51 Favored Glycine 0 CA--C 1.508 -0.348 1 N-CA-C 101.717 -4.553 . . . . 25.0 101.717 -176.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -148.16 165.82 29.74 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.019 1.91 . . . . 25.0 109.414 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -100.59 122.43 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 106.481 -1.674 . . . . 25.0 106.481 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.24 -43.21 52.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.708 -1.133 . . . . 25.0 109.859 -173.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.69 129.76 5.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.194 -1.78 . . . . 25.0 106.194 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.43 130.83 10.69 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.89 0.788 . . . . 25.0 111.386 -0.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.21 113.4 5.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.985 -0.552 . . . . 25.0 112.334 -172.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -72.1 158.23 36.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.038 -0.727 . . . . 25.0 109.038 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -55.32 -25.23 33.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.387 0.675 . . . . 25.0 112.02 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.35 36.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.782 0.801 . . . . 25.0 109.455 176.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -67.61 -35.7 79.44 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.456 -0.793 . . . . 25.0 110.301 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -63.6 -33.18 75.04 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 120.97 -0.292 . . . . 25.0 110.759 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -40.31 96.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.257 0.551 . . . . 25.0 110.092 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.3 tmtm? -68.14 -35.4 78.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.28 0.562 . . . . 25.0 110.071 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.88 4.43 9.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.098 -0.501 . . . . 25.0 111.518 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 58.75 23.69 11.43 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.22 1.408 . . . . 25.0 112.851 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.8 mt -87.89 -22.43 24.4 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.611 -1.255 . . . . 25.0 107.611 174.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -123.62 159.34 29.48 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 105.316 -2.105 . . . . 25.0 105.316 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -135.36 175.23 9.78 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.352 -0.24 . . . . 25.0 110.352 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 70.32 5.4 5.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.783 1.771 . . . . 25.0 115.783 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.47 -34.44 77.94 Favored 'General case' 0 CA--C 1.497 -1.059 0 O-C-N 121.375 -0.828 . . . . 25.0 110.359 172.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.36 -64.14 1.38 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.9 0.75 . . . . 25.0 112.153 179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.9 t -87.98 -53.41 4.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 122.539 1.162 . . . . 25.0 111.633 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.18 -10.73 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 114.523 -1.217 . . . . 25.0 113.233 -171.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -85.5 -3.53 58.89 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.917 -0.489 . . . . 25.0 111.13 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -115.66 -34.09 4.97 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.407 -0.517 . . . . 25.0 110.005 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -126.94 98.81 29.94 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 120.672 0.273 . . . . 25.0 110.798 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.0 Cg_endo -76.92 -20.77 12.92 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 117.619 -1.121 . . . . 25.0 114.312 -174.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -82.27 9.06 9.56 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.211 0.449 . . . . 25.0 112.211 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -64.94 -23.2 67.15 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.15 0.796 . . . . 25.0 113.15 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.06 122.95 15.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 115.226 1.565 . . . . 25.0 115.226 -172.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.93 159.1 42.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 105.778 -1.934 . . . . 25.0 105.778 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.15 -168.58 23.23 Favored Glycine 0 N--CA 1.454 -0.156 0 N-CA-C 108.879 -1.689 . . . . 25.0 108.879 -177.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.4 tp -115.11 147.36 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.241 1.021 . . . . 25.0 112.062 -177.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -65.56 157.03 30.84 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.033 -0.729 . . . . 25.0 109.033 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.57 0.14 2.38 Favored Glycine 0 C--O 1.222 -0.646 0 CA-C-N 114.504 -1.225 . . . . 25.0 113.732 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -75.87 138.36 69.57 Favored Pre-proline 0 C--N 1.322 -0.628 0 O-C-N 121.402 -1.057 . . . . 25.0 110.815 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -92.77 -14.73 18.69 Favored 'Cis proline' 0 CA--C 1.544 0.98 0 C-N-CA 130.259 1.358 . . . . 25.0 115.385 -7.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -69.38 -35.62 76.0 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.162 1.541 . . . . 25.0 115.162 -168.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.97 34.1 4.94 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 105.846 -1.909 . . . . 25.0 105.846 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.78 -170.75 40.36 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.489 -1.232 . . . . 25.0 111.748 -176.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -60.5 170.39 4.34 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.994 2.462 . . . . 25.0 113.104 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 159.84 31.2 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.729 -1.582 . . . . 25.0 106.729 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -61.75 140.26 58.23 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.43 85.6 Favored Glycine 0 N--CA 1.453 -0.206 0 CA-C-N 115.782 -0.645 . . . . 25.0 112.373 -174.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -125.85 12.75 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.954 -0.387 . . . . 25.0 109.954 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.45 -52.87 46.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.122 -0.361 . . . . 25.0 111.824 -173.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.15 -20.04 59.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.889 -0.507 . . . . 25.0 109.969 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 p -83.24 -9.43 59.14 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.889 -0.325 . . . . 25.0 111.826 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.07 34.21 13.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.822 0.849 . . . . 25.0 110.342 -172.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.07 37.33 24.29 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.666 1.358 . . . . 25.0 114.666 -177.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.95 134.7 55.3 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.039 0.536 . . . . 25.0 110.891 175.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 p -62.27 -33.88 75.48 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 115.19 1.552 . . . . 25.0 115.19 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 t -70.67 -8.22 50.33 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.145 0.498 . . . . 25.0 112.296 -178.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.721 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.9 m-85 -120.5 15.83 12.06 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 107.544 -1.28 . . . . 25.0 107.544 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -70.4 -40.48 73.87 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.146 -0.971 . . . . 25.0 111.739 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.59 -15.35 63.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.91 0.862 . . . . 25.0 109.942 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.721 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.65 -6.55 59.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.73 -0.841 . . . . 25.0 108.73 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -112.28 -33.73 6.12 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.236 0.828 . . . . 25.0 113.236 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -96.21 119.41 34.64 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 121.424 -0.798 . . . . 25.0 110.907 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -125.94 161.03 28.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.971 -1.013 . . . . 25.0 109.919 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 53.8 p -116.13 160.66 34.73 Favored Pre-proline 0 C--N 1.319 -0.747 1 N-CA-C 99.857 -4.127 . . . . 25.0 99.857 160.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -70.37 -0.49 7.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 116.995 -1.537 . . . . 25.0 115.794 -174.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.93 10.02 8.83 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.108 0.48 . . . . 25.0 111.471 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -78.49 -29.28 46.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.888 0.699 . . . . 25.0 112.888 -176.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.496 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 5.6 m95 -126.65 165.55 19.0 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.856 -0.424 . . . . 25.0 109.856 -179.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -67.22 131.4 45.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -100.03 105.45 17.12 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 101.325 -3.583 . . . . 25.0 101.325 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.7 136.25 52.6 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.929 -1.032 . . . . 25.0 111.057 -177.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -87.79 106.75 18.28 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.948 -1.024 . . . . 25.0 109.051 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.1 mt -132.38 173.73 10.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 157.94 23.32 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.768 -0.651 . . . . 25.0 110.843 -174.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.448 HG21 ' HA ' ' A' ' 139' ' ' ALA . 64.8 p -77.06 169.8 17.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.099 -1.445 . . . . 25.0 107.099 172.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 89.82 -160.35 28.67 Favored Glycine 0 C--O 1.239 0.439 0 N-CA-C 110.602 -0.999 . . . . 25.0 110.602 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.27 132.32 45.99 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 119.087 1.443 . . . . 25.0 114.218 -177.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.88 161.43 36.65 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.281 -1.748 . . . . 25.0 106.281 178.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 p -104.35 151.15 23.81 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.616 -1.254 . . . . 25.0 107.616 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -139.31 100.95 4.13 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.83 115.04 29.82 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 122.169 0.985 . . . . 25.0 109.483 -179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.7 m95 -101.17 148.43 25.1 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.964 -1.016 . . . . 25.0 109.701 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.9 111.1 13.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.215 -2.143 . . . . 25.0 105.215 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.73 128.49 56.44 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.619 0.768 . . . . 25.0 111.73 -173.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -32.61 23.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.315 0.579 . . . . 25.0 109.623 174.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.4 122.01 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.842 0.353 . . . . 25.0 110.54 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -82.59 3.33 29.15 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.78 152.98 44.47 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.653 -0.419 . . . . 25.0 109.997 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -68.99 156.0 39.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 114.308 1.225 . . . . 25.0 114.308 -171.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.408 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 13.4 t -96.88 159.78 14.73 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.181 -1.044 . . . . 25.0 108.181 173.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.9 t -117.86 -16.13 9.97 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 123.143 0.277 . . . . 25.0 110.442 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.53 160.2 4.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.207 0.527 . . . . 25.0 112.224 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -128.48 134.93 48.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.071 -2.566 . . . . 25.0 104.071 168.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -140.34 150.05 43.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.873 -0.788 . . . . 25.0 108.873 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.94 138.14 38.67 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.641 -1.614 . . . . 25.0 106.641 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -149.62 161.57 41.9 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.545 0.611 . . . . 25.0 110.305 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.96 163.29 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 114.014 1.116 . . . . 25.0 114.014 -169.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 21.9 p -77.73 164.19 25.48 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.238 -1.023 . . . . 25.0 108.238 171.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -64.3 159.75 55.65 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 107.838 -1.171 . . . . 25.0 107.838 176.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -68.57 -26.37 33.9 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 115.921 -2.253 . . . . 25.0 113.983 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -114.08 32.01 6.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.881 0.473 . . . . 25.0 111.037 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.471 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -68.39 168.85 11.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.05 0.929 . . . . 25.0 112.91 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -83.17 100.97 10.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.602 -1.181 . . . . 25.0 109.461 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.471 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -92.86 8.9 37.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.895 1.813 . . . . 25.0 115.895 -169.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.4 t -125.62 13.69 8.09 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.644 -0.872 . . . . 25.0 108.644 177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -116.94 158.61 43.57 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.281 -1.327 . . . . 25.0 107.677 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -65.69 152.7 80.93 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 118.22 -0.72 . . . . 25.0 111.248 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mp -69.53 101.97 1.72 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.786 0.661 . . . . 25.0 112.786 -175.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.3 p -95.44 153.75 17.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.876 -1.157 . . . . 25.0 107.876 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -64.13 -24.51 67.72 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.065 0.459 . . . . 25.0 111.559 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.4 -26.79 67.41 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 25.0 112.415 177.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -80.59 -6.57 58.48 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.598 0.592 . . . . 25.0 112.598 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 50.5 m-85 -105.41 157.51 17.3 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -175.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.14 96.25 7.98 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 102.606 -3.109 . . . . 25.0 102.606 162.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.98 -6.82 24.24 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.938 1.459 . . . . 25.0 114.938 -169.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.4 t -79.88 133.47 58.34 Favored Pre-proline 0 C--N 1.321 -0.635 0 N-CA-C 108.995 -0.742 . . . . 25.0 108.995 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -72.37 148.38 48.73 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 114.824 -2.984 . . . . 25.0 110.596 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -102.67 -8.32 21.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.032 0.444 . . . . 25.0 111.277 -179.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.23 68.86 1.04 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.962 -0.563 . . . . 25.0 109.894 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -88.93 129.39 35.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 119.488 -0.885 . . . . 25.0 108.931 177.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -121.45 98.98 6.22 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 104.272 -2.492 . . . . 25.0 104.272 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -90.99 92.01 8.57 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.014 -1.106 . . . . 25.0 108.014 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -110.77 117.42 33.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.994 -1.484 . . . . 25.0 106.994 175.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.18 82.72 0.35 Allowed Glycine 0 CA--C 1.501 -0.819 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.717 -170.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 122.64 13.19 4.74 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 120.98 -0.628 . . . . 25.0 113.812 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.28 104.04 5.69 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.7 mt -74.76 122.83 88.35 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.51 156.8 49.61 Favored 'Trans proline' 0 C--N 1.345 0.389 0 N-CA-C 114.503 0.924 . . . . 25.0 114.503 -176.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -99.14 29.39 3.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 73.56 -15.89 0.53 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.881 1.673 . . . . 25.0 112.601 -176.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -130.55 148.97 52.41 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.5 t -142.48 94.96 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 106.996 -1.483 . . . . 25.0 106.996 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.1 t -88.71 136.89 32.77 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.9 166.94 23.27 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 106.12 -1.807 . . . . 25.0 106.12 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -133.46 152.87 51.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.415 -2.069 . . . . 25.0 105.415 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.65 159.54 33.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.795 -1.187 . . . . 25.0 107.795 -178.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -105.29 115.52 30.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.737 0.273 . . . . 25.0 111.737 -175.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.79 132.6 64.03 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 108.753 -0.832 . . . . 25.0 108.753 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -61.66 146.81 96.51 Favored 'Trans proline' 0 C--N 1.354 0.864 0 N-CA-C 113.682 0.609 . . . . 25.0 113.682 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.448 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.57 -29.56 41.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.98 -168.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -81.88 7.07 13.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.584 -0.735 . . . . 25.0 110.594 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.1 mmt-85 -114.03 51.9 0.85 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.027 -1.101 . . . . 25.0 108.027 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.09 170.96 11.73 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.557 -1.645 . . . . 25.0 106.557 175.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 86.89 -167.37 38.17 Favored Glycine 0 C--N 1.321 -0.263 0 N-CA-C 116.213 1.245 . . . . 25.0 116.213 176.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.4 t -86.03 106.91 17.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.41 0.624 . . . . 25.0 110.985 -168.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -158.2 171.25 20.54 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.907 -0.588 . . . . 25.0 111.623 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -105.7 150.22 8.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 64.2 mt -131.94 122.84 50.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -106.88 132.96 52.24 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.192 -0.913 . . . . 25.0 109.998 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.4 137.73 54.43 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 122.905 0.482 . . . . 25.0 109.76 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.6 p -128.8 138.0 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 114.04 1.126 . . . . 25.0 114.04 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.408 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.3 t90 -98.44 121.6 40.59 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 105.086 -2.191 . . . . 25.0 105.086 170.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -106.17 119.35 39.01 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.815 -1.18 . . . . 25.0 107.815 -176.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 22.2 mm -84.71 137.97 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 122.031 -0.418 . . . . 25.0 112.092 -171.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -77.9 -45.12 25.01 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.57 -0.706 . . . . 25.0 111.094 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.22 -25.9 65.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.697 1.369 . . . . 25.0 114.697 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 69.6 p -139.31 165.9 25.96 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.444 0.64 . . . . 25.0 109.607 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.62 29.84 0.25 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.555 -0.748 . . . . 25.0 112.642 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -99.05 147.94 24.53 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -177.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.32 144.94 12.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 171.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -146.75 130.62 17.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.996 0.369 . . . . 25.0 111.996 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -91.7 118.08 30.34 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.527 0.517 . . . . 25.0 110.776 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -97.17 116.74 29.93 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.875 -1.158 . . . . 25.0 107.875 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.82 140.16 29.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.951 -0.568 . . . . 25.0 112.117 -176.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -126.93 134.31 66.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 105.945 -1.872 . . . . 25.0 105.945 167.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -94.08 130.43 40.24 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 176.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.1 m -132.06 162.8 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 113.08 0.77 . . . . 25.0 113.08 -174.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -118.06 95.11 4.76 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.78 163.9 14.29 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.008 -0.542 . . . . 25.0 112.109 -172.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 63.3 p -143.83 151.82 40.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.686 -0.487 . . . . 25.0 109.686 175.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 117.791 -1.099 . . . . 25.0 112.345 -176.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.496 0.665 . . . . 25.0 110.389 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 170.61 36.62 Favored Glycine 0 CA--C 1.508 -0.395 1 N-CA-C 101.375 -4.69 . . . . 25.0 101.375 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -147.85 164.78 32.6 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 120.402 2.101 . . . . 25.0 110.336 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -101.03 122.3 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 107.639 -1.245 . . . . 25.0 107.639 176.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.61 -42.36 61.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.72 -1.127 . . . . 25.0 109.974 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 t -153.34 129.5 5.36 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 164' ' ' ILE . 68.0 Cg_endo -64.76 133.81 17.78 Favored 'Cis proline' 0 CA--C 1.533 0.464 0 C-N-CA 128.791 0.746 . . . . 25.0 111.103 -0.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 110.49 3.21 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.576 0.584 . . . . 25.0 112.576 -172.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.2 t -71.94 157.17 38.33 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.2 mtp180 -55.42 -24.98 33.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.478 0.711 . . . . 25.0 112.272 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.76 -53.99 38.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.826 0.822 . . . . 25.0 109.539 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -68.26 -33.06 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.501 -0.772 . . . . 25.0 110.818 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.9 -33.17 74.74 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 122.009 -0.432 . . . . 25.0 110.449 177.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -65.59 -38.99 91.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.72 -0.474 . . . . 25.0 109.72 178.325 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -64.48 -36.75 85.21 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.202 0.525 . . . . 25.0 110.263 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -78.22 5.8 9.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.037 -0.528 . . . . 25.0 111.473 177.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 58.73 25.74 13.78 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.137 1.375 . . . . 25.0 112.751 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -91.78 -18.88 23.22 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -122.35 158.25 30.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.9 p -133.93 175.23 9.65 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 122.866 0.466 . . . . 25.0 109.956 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 68.12 5.29 4.55 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.848 1.796 . . . . 25.0 115.848 175.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.1 m -68.66 -35.37 77.15 Favored 'General case' 0 CA--C 1.504 -0.811 0 O-C-N 121.601 -0.687 . . . . 25.0 112.025 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.42 -62.96 1.83 Allowed Glycine 0 C--O 1.22 -0.743 0 O-C-N 123.813 0.695 . . . . 25.0 111.804 -177.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -88.01 -50.1 6.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 114.74 1.385 . . . . 25.0 114.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 25' ' ' VAL . 2.1 t -65.08 -13.07 14.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 114.549 -1.205 . . . . 25.0 114.146 -165.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -82.59 -9.97 59.17 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.24 -0.984 . . . . 25.0 111.563 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -105.99 -34.09 7.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.266 -0.574 . . . . 25.0 109.479 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -127.1 98.9 29.29 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.638 -0.255 . . . . 25.0 111.246 172.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.16 -21.58 20.2 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 117.281 -1.346 . . . . 25.0 113.907 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -87.97 15.26 7.49 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.193 0.442 . . . . 25.0 112.193 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.8 m -61.62 -25.27 67.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.973 0.416 . . . . 25.0 111.874 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.94 117.93 5.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 115.514 1.672 . . . . 25.0 115.514 -173.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -152.95 157.28 40.36 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 105.231 -2.137 . . . . 25.0 105.231 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.76 -164.79 16.32 Favored Glycine 0 CA--C 1.51 -0.278 0 N-CA-C 108.656 -1.778 . . . . 25.0 108.656 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -118.15 149.79 40.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.432 1.116 . . . . 25.0 112.6 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.88 156.99 31.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.012 -1.107 . . . . 25.0 108.012 171.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.55 -2.77 1.77 Allowed Glycine 0 C--O 1.225 -0.459 0 CA-C-N 114.671 -1.149 . . . . 25.0 113.418 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.69 140.68 71.53 Favored Pre-proline 0 C--N 1.323 -0.571 0 O-C-N 121.518 -0.99 . . . . 25.0 110.676 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -92.84 -14.15 19.83 Favored 'Cis proline' 0 CA--C 1.543 0.937 0 C-N-CA 130.195 1.331 . . . . 25.0 115.243 -7.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -71.79 -36.87 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.193 1.553 . . . . 25.0 115.193 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.17 34.07 5.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.5 -174.62 44.64 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 114.533 -1.212 . . . . 25.0 111.717 -176.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.53 172.67 1.9 Allowed 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 123.663 2.909 . . . . 25.0 112.85 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.16 159.96 30.99 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 106.858 -1.534 . . . . 25.0 106.858 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.04 140.76 55.41 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.097 -1.446 . . . . 25.0 107.097 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.23 -6.93 77.87 Favored Glycine 0 C--O 1.23 -0.114 0 C-N-CA 121.294 -0.479 . . . . 25.0 112.958 -174.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -124.89 9.68 8.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.376 -0.485 . . . . 25.0 109.847 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.9 mt -66.98 -50.75 61.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 122.044 -0.41 . . . . 25.0 111.405 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.06 -21.38 59.95 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.92 -0.488 . . . . 25.0 109.839 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.6 p -82.66 -9.46 59.37 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.844 -0.343 . . . . 25.0 111.821 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.29 37.61 19.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.721 0.808 . . . . 25.0 110.416 -172.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.6 t70 63.12 32.59 15.11 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.736 1.384 . . . . 25.0 114.736 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -118.97 134.54 55.12 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.785 -0.572 . . . . 25.0 111.973 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 p -62.82 -35.09 78.78 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 115.717 1.747 . . . . 25.0 115.717 -173.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.76 -8.03 49.33 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.254 0.549 . . . . 25.0 112.05 -178.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.688 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.0 m-85 -121.38 14.71 11.23 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 107.734 -1.21 . . . . 25.0 107.734 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -69.16 -41.14 77.63 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.108 -0.995 . . . . 25.0 111.038 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -73.87 -11.25 60.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.913 0.863 . . . . 25.0 109.675 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.688 HD13 ' HA ' ' A' ' 56' ' ' PHE . 3.0 mp -86.2 -3.43 58.97 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -114.48 -32.87 5.77 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.02 0.378 . . . . 25.0 112.02 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -97.46 120.66 38.23 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 121.477 -0.764 . . . . 25.0 110.299 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.418 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -125.83 160.97 28.46 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.316 -0.857 . . . . 25.0 109.684 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.5 p -114.99 161.19 30.53 Favored Pre-proline 0 C--N 1.318 -0.768 1 N-CA-C 99.58 -4.23 . . . . 25.0 99.58 160.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.57 -2.64 10.39 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 116.823 -1.651 . . . . 25.0 116.127 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -126.1 11.49 7.63 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.754 0.787 . . . . 25.0 111.282 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -79.59 -29.86 41.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.276 -0.89 . . . . 25.0 112.969 -176.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.418 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.1 m95 -125.6 167.01 15.68 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 110.022 -0.362 . . . . 25.0 110.022 -177.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -68.2 125.7 27.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 172.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -99.22 106.12 18.24 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 100.202 -3.999 . . . . 25.0 100.202 176.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.85 135.12 52.03 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.175 -0.92 . . . . 25.0 110.495 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -89.77 100.68 13.44 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.848 -1.167 . . . . 25.0 107.848 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.3 mt -131.28 174.03 10.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.244 -1.021 . . . . 25.0 108.244 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.67 155.6 24.19 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.478 -0.783 . . . . 25.0 111.666 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 54.2 p -77.28 167.21 22.1 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 172.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.97 -162.08 22.87 Favored Glycine 0 C--O 1.241 0.553 0 N-CA-C 110.712 -0.955 . . . . 25.0 110.712 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 133.87 56.65 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 118.958 1.379 . . . . 25.0 114.043 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.42 159.54 41.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.45 -1.685 . . . . 25.0 106.45 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.8 p -106.12 152.97 22.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 106.923 -1.51 . . . . 25.0 106.923 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -138.28 101.06 4.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 105.238 -2.134 . . . . 25.0 105.238 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.1 107.78 20.34 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.865 0.84 . . . . 25.0 110.114 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -97.21 146.47 25.06 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.426 -0.806 . . . . 25.0 110.074 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -124.89 112.11 16.24 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.67 108.5 17.98 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.437 -0.801 . . . . 25.0 111.225 -172.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -71.69 -32.73 68.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.443 0.639 . . . . 25.0 109.861 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.49 117.56 23.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.495 -0.557 . . . . 25.0 109.495 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -72.64 -5.73 39.46 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.654 1.353 . . . . 25.0 114.654 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.94 156.61 23.96 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -72.87 156.03 39.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 113.762 1.023 . . . . 25.0 113.762 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 12.4 t -99.96 157.67 16.37 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.527 -0.916 . . . . 25.0 108.527 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -118.12 -14.7 9.91 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.117 0.261 . . . . 25.0 111.617 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.7 t -172.58 152.66 2.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.849 0.356 . . . . 25.0 111.51 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 51.5 m95 -122.92 138.91 54.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 104.599 -2.371 . . . . 25.0 104.599 167.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -143.49 147.03 33.9 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -136.15 132.86 36.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.169 -1.789 . . . . 25.0 106.169 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.83 161.8 41.1 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.446 0.566 . . . . 25.0 110.197 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.29 165.96 30.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 113.427 0.899 . . . . 25.0 113.427 -167.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 17.0 p -80.36 160.3 25.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.49 -1.3 . . . . 25.0 107.49 169.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -61.89 159.41 36.3 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.29 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 -24.36 34.51 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 116.256 -2.029 . . . . 25.0 114.234 -173.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -114.43 32.05 6.21 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.398 . . . . 25.0 111.358 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -74.15 166.99 22.46 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.952 0.882 . . . . 25.0 112.87 -176.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -83.0 100.99 10.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.683 -1.144 . . . . 25.0 110.031 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.31 15.46 10.47 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 116.421 2.008 . . . . 25.0 116.421 -169.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.7 t -124.29 9.03 8.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.814 -0.81 . . . . 25.0 108.814 175.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -112.52 158.44 37.35 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 114.544 -1.207 . . . . 25.0 108.077 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.82 154.61 71.96 Favored 'Trans proline' 0 C--N 1.347 0.481 0 O-C-N 121.863 0.401 . . . . 25.0 111.953 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.05 105.14 3.8 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.364 0.602 . . . . 25.0 111.046 -177.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.6 p -94.04 154.43 17.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -63.59 -26.58 68.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.035 -0.415 . . . . 25.0 111.639 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.07 62.65 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.714 177.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.0 t -76.73 -20.79 56.13 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.627 0.727 . . . . 25.0 111.305 -178.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.421 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 55.8 m-85 -88.21 154.95 20.02 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 115.134 1.531 . . . . 25.0 115.134 -176.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -92.3 95.85 9.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 102.301 -3.222 . . . . 25.0 102.301 161.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 79.9 mt -66.96 -6.85 18.42 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.77 1.396 . . . . 25.0 114.77 -169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.0 t -85.97 130.35 50.71 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.314 -0.995 . . . . 25.0 108.314 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.93 148.99 52.55 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 115.509 -2.528 . . . . 25.0 111.457 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -100.07 -9.1 22.99 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.123 0.487 . . . . 25.0 111.266 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.0 m -149.23 69.48 1.06 Allowed 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.943 -0.571 . . . . 25.0 109.561 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -88.99 134.58 33.93 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.566 -0.854 . . . . 25.0 109.185 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.51 99.04 5.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 105.849 -1.908 . . . . 25.0 105.849 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -91.98 92.08 8.14 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -105.14 118.34 36.28 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 106.796 -1.557 . . . . 25.0 106.796 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.27 79.9 0.47 Allowed Glycine 0 CA--C 1.502 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 114.082 -167.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.84 22.44 6.63 Favored Glycine 0 C--N 1.32 -0.361 0 C-N-CA 120.861 -0.685 . . . . 25.0 112.61 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.27 105.68 5.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.415 0.626 . . . . 25.0 109.343 177.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.49 122.78 87.56 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 105.596 -2.001 . . . . 25.0 105.596 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.73 168.11 24.19 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 117.714 -1.057 . . . . 25.0 113.872 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.99 24.29 4.36 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.693 -0.855 . . . . 25.0 108.693 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.83 -17.97 0.28 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.843 1.657 . . . . 25.0 112.602 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -129.06 148.04 50.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 104.028 -2.582 . . . . 25.0 104.028 170.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.86 94.95 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.049 -1.463 . . . . 25.0 107.049 -178.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.4 m -85.71 100.06 11.74 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 107.894 -1.15 . . . . 25.0 107.894 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.08 166.53 11.55 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.303 -1.369 . . . . 25.0 107.303 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -134.64 153.58 51.91 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 170.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -164.38 160.59 20.93 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.922 -1.14 . . . . 25.0 107.922 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -105.21 117.26 33.56 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.172 0.295 . . . . 25.0 110.948 -176.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.14 130.95 67.77 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 107.924 -1.139 . . . . 25.0 107.924 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -62.2 147.31 95.26 Favored 'Trans proline' 0 C--N 1.353 0.793 0 CA-C-O 121.682 0.617 . . . . 25.0 113.402 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.418 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.11 -25.65 36.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.222 -0.899 . . . . 25.0 112.653 -169.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 p-10 -83.76 9.4 11.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.698 0.761 . . . . 25.0 110.225 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -115.13 53.3 0.83 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.189 -1.041 . . . . 25.0 108.189 171.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 32.3 p -86.11 166.69 15.6 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 106.414 -1.699 . . . . 25.0 106.414 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.16 -166.76 35.41 Favored Glycine 0 C--N 1.319 -0.384 0 N-CA-C 115.459 0.944 . . . . 25.0 115.459 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.01 108.31 18.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.488 0.661 . . . . 25.0 110.938 -168.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.411 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.9 p-80 -156.94 171.18 20.91 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.834 -0.621 . . . . 25.0 110.819 -176.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 p -107.8 150.6 10.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 49.8 mt -131.5 120.1 44.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.489 -2.041 . . . . 25.0 105.489 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.56 132.73 51.36 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.04 135.1 50.33 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.993 -0.373 . . . . 25.0 109.993 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.7 p -122.01 144.2 32.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 122.075 0.941 . . . . 25.0 112.572 -177.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.6 t90 -112.48 105.62 13.9 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.173 -2.158 . . . . 25.0 105.173 173.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.17 127.37 35.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.569 -1.271 . . . . 25.0 107.569 179.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.0 mm -83.62 140.68 15.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.768 -0.456 . . . . 25.0 109.768 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.38 -42.78 24.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.353 0.597 . . . . 25.0 110.477 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.13 -24.62 65.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.734 1.012 . . . . 25.0 113.734 -172.209 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.6 p -139.49 171.21 14.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.999 0.904 . . . . 25.0 110.206 -174.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.6 20.21 0.74 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.239 -0.891 . . . . 25.0 112.209 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -90.1 146.48 24.28 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.057 0.762 . . . . 25.0 113.057 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.06 144.61 11.48 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -147.95 127.19 12.98 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -84.34 117.13 23.4 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.04 0.448 . . . . 25.0 110.732 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -97.1 112.53 24.26 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.81 141.02 29.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.432 -0.804 . . . . 25.0 111.869 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.6 tt -125.15 134.87 65.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 105.607 -1.997 . . . . 25.0 105.607 166.373 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -93.65 131.25 39.14 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.885 -1.524 . . . . 25.0 106.885 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.4 m -132.5 161.24 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.652 0.612 . . . . 25.0 112.652 -175.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.68 95.05 4.68 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 103.729 -2.693 . . . . 25.0 103.729 167.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.4 tp -90.4 163.18 14.78 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 112.558 0.577 . . . . 25.0 112.558 -171.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 74.9 p -145.88 164.09 33.04 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.493 -0.929 . . . . 25.0 108.493 177.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.069 -0.967 . . . . 25.0 110.515 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.0 m80 . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.356 0.598 . . . . 25.0 110.473 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.22 169.58 35.84 Favored Glycine 0 C--N 1.32 -0.348 1 N-CA-C 101.077 -4.809 . . . . 25.0 101.077 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.469 ' HA ' HE22 ' A' ' 162' ' ' GLN . 36.7 p90 -143.97 165.71 27.0 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 120.124 1.962 . . . . 25.0 110.2 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -102.46 121.23 53.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 106.17 -1.789 . . . . 25.0 106.17 176.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -74.04 -41.43 61.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.53 -1.213 . . . . 25.0 109.553 -174.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -154.17 129.22 4.97 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 105.987 -1.857 . . . . 25.0 105.987 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -65.28 131.56 13.29 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 128.828 0.761 . . . . 25.0 111.543 -0.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 113.15 4.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.996 -0.547 . . . . 25.0 111.594 -173.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.4 p -72.13 163.71 27.44 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.273 -0.639 . . . . 25.0 109.273 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -59.73 -21.86 61.25 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.146 0.498 . . . . 25.0 111.797 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.28 -53.68 27.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.934 -0.765 . . . . 25.0 108.934 174.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.01 -35.81 81.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.684 -0.689 . . . . 25.0 110.759 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.41 -32.62 74.32 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.13 -0.356 . . . . 25.0 111.024 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 25.0 109.839 177.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -66.77 -36.09 81.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.141 0.496 . . . . 25.0 109.864 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.97 3.61 11.84 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.357 -0.383 . . . . 25.0 111.964 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 58.53 21.84 9.03 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.094 1.357 . . . . 25.0 112.836 -178.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.5 mt -84.72 -21.17 30.19 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.284 -1.376 . . . . 25.0 107.284 173.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 -123.19 157.73 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 104.736 -2.32 . . . . 25.0 104.736 176.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 p -135.26 176.67 8.46 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.575 -0.528 . . . . 25.0 109.575 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 69.83 5.05 5.04 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.536 1.68 . . . . 25.0 115.536 174.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -68.06 -38.84 82.91 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 121.402 -0.811 . . . . 25.0 110.844 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.32 -63.81 1.74 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.683 0.614 . . . . 25.0 112.037 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -87.97 -52.45 5.26 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 122.503 1.144 . . . . 25.0 111.889 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.469 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.8 OUTLIER -67.86 -11.82 14.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.469 -1.241 . . . . 25.0 113.248 -171.83 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -85.6 -1.44 57.13 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 121.739 -0.601 . . . . 25.0 111.487 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.41 -34.08 4.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.056 -0.657 . . . . 25.0 110.349 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -127.04 95.79 35.99 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 120.7 0.286 . . . . 25.0 110.349 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' HG12 ' A' ' 25' ' ' VAL . 82.7 Cg_endo -70.63 -19.39 32.04 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 115.05 1.134 . . . . 25.0 115.05 -177.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -87.02 10.92 14.96 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.772 -0.58 . . . . 25.0 112.404 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.9 m -62.52 -18.29 61.64 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.559 0.577 . . . . 25.0 112.559 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.1 m -64.13 122.35 14.86 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 114.875 1.435 . . . . 25.0 114.875 -175.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -153.04 155.23 36.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.601 -1.629 . . . . 25.0 106.601 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.62 -167.09 19.77 Favored Glycine 0 CA--C 1.512 -0.123 0 N-CA-C 107.838 -2.105 . . . . 25.0 107.838 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 tp -117.93 149.77 40.35 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.536 1.168 . . . . 25.0 111.891 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -65.02 156.93 29.81 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.36 -1.348 . . . . 25.0 107.36 171.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.89 4.57 2.98 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-N 114.848 -1.069 . . . . 25.0 113.73 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -75.99 143.22 73.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 121.528 -0.983 . . . . 25.0 109.263 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.22 -16.93 17.24 Favored 'Cis proline' 0 CA--C 1.543 0.934 0 N-CA-C 115.635 1.36 . . . . 25.0 115.635 -5.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -70.85 -37.75 73.15 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.95 1.463 . . . . 25.0 114.95 -169.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -113.26 28.47 8.76 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.067 -1.827 . . . . 25.0 106.067 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.09 -176.43 45.06 Favored Glycine 0 N--CA 1.445 -0.702 0 CA-C-N 114.567 -1.197 . . . . 25.0 110.692 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.59 175.17 1.77 Allowed 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 123.781 2.987 . . . . 25.0 113.222 177.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.04 160.03 31.01 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.683 -1.599 . . . . 25.0 106.683 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.25 140.07 57.23 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 175.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.33 -5.9 83.26 Favored Glycine 0 C--O 1.229 -0.212 0 CA-C-O 121.349 0.416 . . . . 25.0 112.785 -174.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 60.1 m170 -125.76 8.88 7.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.453 -0.44 . . . . 25.0 110.962 178.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.8 mt -64.52 -46.8 91.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 121.915 -0.491 . . . . 25.0 110.968 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.39 -12.09 59.98 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.078 -0.389 . . . . 25.0 110.482 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 p -94.0 -7.58 42.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.01 33.97 12.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.555 0.742 . . . . 25.0 110.758 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 61.38 32.55 19.06 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.339 1.237 . . . . 25.0 114.339 -178.314 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -118.46 137.61 53.05 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.124 0.488 . . . . 25.0 111.608 176.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.85 -34.88 78.27 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 115.233 1.568 . . . . 25.0 115.233 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.5 t -71.46 -7.41 47.26 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.27 0.557 . . . . 25.0 112.468 -177.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.682 ' HA ' HD13 ' A' ' 59' ' ' LEU . 16.3 m-85 -120.37 12.5 11.69 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 107.161 -1.422 . . . . 25.0 107.161 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -72.12 -35.08 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.081 -1.012 . . . . 25.0 110.171 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mp0 -70.08 -16.56 63.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.897 0.856 . . . . 25.0 109.864 175.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.682 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.3 mp -87.42 -5.93 58.64 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 -176.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -114.14 -31.96 6.16 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 112.384 0.513 . . . . 25.0 112.384 174.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -95.1 118.15 31.41 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.539 -0.726 . . . . 25.0 110.342 -178.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.436 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -126.38 161.01 28.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.109 -0.701 . . . . 25.0 109.109 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.1 p -118.81 161.6 35.28 Favored Pre-proline 0 C--N 1.317 -0.813 0 N-CA-C 100.245 -3.983 . . . . 25.0 100.245 162.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.4 -5.09 15.13 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 116.728 -1.715 . . . . 25.0 115.588 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.4 t -123.66 10.03 9.0 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.063 0.459 . . . . 25.0 111.71 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -79.07 -30.46 43.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.724 0.638 . . . . 25.0 112.724 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.436 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 14.5 m95 -123.51 165.78 16.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 120.698 0.285 . . . . 25.0 110.516 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -67.72 129.17 39.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 105.471 -2.048 . . . . 25.0 105.471 169.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -100.15 105.84 17.49 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 101.249 -3.612 . . . . 25.0 101.249 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.75 135.79 54.51 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.819 -1.082 . . . . 25.0 109.93 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -93.43 106.17 18.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.826 -1.079 . . . . 25.0 109.091 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -131.64 173.71 10.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.655 -1.239 . . . . 25.0 107.655 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.73 157.34 23.32 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.727 -0.669 . . . . 25.0 110.421 -176.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.454 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.8 p -77.28 166.76 22.77 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.921 -1.511 . . . . 25.0 106.921 173.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.52 -161.78 23.18 Favored Glycine 0 C--O 1.241 0.539 0 N-CA-C 110.336 -1.106 . . . . 25.0 110.336 -177.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.23 132.54 47.33 Favored 'Trans proline' 0 C--N 1.346 0.408 0 CA-C-N 119.147 1.473 . . . . 25.0 114.288 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -138.93 161.31 37.64 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.1 p -103.43 150.91 23.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -138.15 100.92 4.27 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.467 -2.049 . . . . 25.0 105.467 -178.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.78 116.13 31.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 122.041 0.924 . . . . 25.0 110.023 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -100.48 149.2 23.93 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.151 -0.931 . . . . 25.0 109.85 178.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -127.92 115.05 17.96 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.494 -2.409 . . . . 25.0 104.494 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -114.37 121.93 45.13 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.101 -0.954 . . . . 25.0 110.791 -172.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.4 t -74.48 -29.72 61.55 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.51 0.671 . . . . 25.0 110.141 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.62 133.38 35.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.03 0.443 . . . . 25.0 110.856 -177.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -77.92 -5.77 52.18 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.748 0.648 . . . . 25.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -63.97 156.86 26.6 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.353 0.872 . . . . 25.0 113.353 -175.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.4 t -77.63 155.97 31.08 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.561 1.319 . . . . 25.0 114.561 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -103.67 156.23 17.95 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.024 -0.535 . . . . 25.0 109.711 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -118.03 -14.81 9.96 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.227 0.454 . . . . 25.0 112.227 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.4 t -172.54 154.1 3.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.976 0.417 . . . . 25.0 111.525 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.3 m95 -128.06 134.73 49.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.83 -2.285 . . . . 25.0 104.83 168.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -141.0 149.61 41.99 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.373 -0.973 . . . . 25.0 108.373 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -137.95 135.29 35.89 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 105.731 -1.951 . . . . 25.0 105.731 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.98 160.9 42.88 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.183 0.447 . . . . 25.0 109.938 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.35 166.5 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 112.736 0.643 . . . . 25.0 112.736 -167.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 p -79.6 158.7 27.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -62.32 158.91 44.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.109 -0.95 . . . . 25.0 109.859 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.52 -15.64 38.11 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 117.894 -0.937 . . . . 25.0 114.179 -174.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -118.66 32.06 6.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.721 0.408 . . . . 25.0 111.882 -176.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.52 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -79.14 161.58 26.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.819 0.819 . . . . 25.0 112.076 -177.208 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -83.11 101.03 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.703 -1.135 . . . . 25.0 110.098 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.52 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -83.98 16.68 2.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 116.928 2.195 . . . . 25.0 116.928 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -123.87 5.16 8.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.587 0.708 . . . . 25.0 109.179 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -108.71 157.45 36.68 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 114.838 -1.074 . . . . 25.0 108.499 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.71 154.9 70.08 Favored 'Trans proline' 0 C--N 1.346 0.415 0 O-C-N 121.968 0.457 . . . . 25.0 112.695 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.26 112.25 9.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.321 0.581 . . . . 25.0 110.945 -177.028 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.8 p -104.7 156.8 17.66 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -63.82 -27.04 68.9 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 122.087 -0.383 . . . . 25.0 111.735 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -25.16 61.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.91 -0.586 . . . . 25.0 112.075 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.2 t -78.29 -20.43 51.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.177 0.513 . . . . 25.0 111.149 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -89.78 153.86 20.36 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 115.077 1.51 . . . . 25.0 115.077 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -90.8 97.93 11.47 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 103.133 -2.914 . . . . 25.0 103.133 162.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -67.46 -5.87 16.86 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.82 1.415 . . . . 25.0 114.82 -170.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -88.44 128.64 52.27 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.206 -1.035 . . . . 25.0 108.206 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.04 145.73 50.5 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.325 -2.65 . . . . 25.0 111.422 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -95.17 -9.13 34.32 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.916 0.389 . . . . 25.0 111.788 -177.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 55.6 m -151.39 69.35 0.94 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.082 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.15 133.57 34.35 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 118.775 -1.17 . . . . 25.0 109.858 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.36 99.06 6.27 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -93.26 92.07 7.54 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 107.229 -1.397 . . . . 25.0 107.229 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -108.81 118.36 36.6 Favored 'General case' 0 C--O 1.216 -0.675 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 178.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -93.61 76.63 1.09 Allowed Glycine 0 CA--C 1.503 -0.705 0 CA-C-N 115.434 -0.803 . . . . 25.0 114.772 -168.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 105.11 25.34 6.79 Favored Glycine 0 C--N 1.319 -0.388 0 C-N-CA 121.011 -0.614 . . . . 25.0 113.122 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.89 106.35 3.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.649 0.738 . . . . 25.0 109.724 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.05 123.72 88.8 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 106.712 -1.588 . . . . 25.0 106.712 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.33 172.41 15.4 Favored 'Trans proline' 0 C--N 1.344 0.327 0 N-CA-C 113.887 0.687 . . . . 25.0 113.887 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.407 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -99.53 27.68 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.017 -1.105 . . . . 25.0 108.017 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.24 -9.84 0.58 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.622 1.569 . . . . 25.0 112.129 -173.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' A' ' 128' ' ' ALA . 60.8 mt-30 -131.48 151.65 51.39 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 103.849 -2.649 . . . . 25.0 103.849 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -142.1 95.18 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 106.924 -1.51 . . . . 25.0 106.924 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.5 t -94.37 126.88 39.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 107.179 -1.415 . . . . 25.0 107.179 175.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -133.17 166.92 21.33 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 105.299 -2.111 . . . . 25.0 105.299 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -131.33 151.07 51.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 173.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.07 158.95 37.39 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.791 -1.189 . . . . 25.0 107.791 -177.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -102.21 116.17 32.1 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.091 0.245 . . . . 25.0 111.15 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.8 mt -76.91 131.26 73.65 Favored Pre-proline 0 C--O 1.241 0.606 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.37 146.41 97.26 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-O 121.655 0.606 . . . . 25.0 113.527 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.01 -26.24 36.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.186 -0.915 . . . . 25.0 112.588 -168.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -84.31 10.78 9.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 25.0 110.172 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.5 mmt-85 -116.15 50.65 1.02 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.45 -0.944 . . . . 25.0 108.45 171.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.0 p -85.86 164.63 17.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.491 -1.3 . . . . 25.0 107.491 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.69 -166.91 31.81 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 114.648 0.619 . . . . 25.0 114.648 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.3 t -86.02 112.43 21.22 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.353 0.596 . . . . 25.0 110.354 -169.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -159.46 172.27 18.2 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.711 -0.677 . . . . 25.0 110.317 -176.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.07 151.69 10.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.3 mt -133.13 122.32 45.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 104.895 -2.261 . . . . 25.0 104.895 -178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.41 134.55 50.3 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.557 -0.747 . . . . 25.0 109.919 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -125.12 134.44 52.45 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.791 0.436 . . . . 25.0 110.078 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.21 142.91 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 122.322 1.058 . . . . 25.0 112.438 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -111.49 114.58 27.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 105.737 -1.949 . . . . 25.0 105.737 173.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -94.69 122.31 37.16 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.842 -1.17 . . . . 25.0 107.842 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.5 mm -78.69 142.42 14.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.543 -0.54 . . . . 25.0 109.543 -177.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.54 -42.94 21.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.924 0.784 . . . . 25.0 110.108 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -23.89 64.79 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.649 0.981 . . . . 25.0 113.649 -172.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.3 p -139.09 168.61 19.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.901 0.858 . . . . 25.0 109.988 -175.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.24 21.39 0.75 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.285 -0.871 . . . . 25.0 112.334 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -90.7 147.27 23.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.35 143.41 11.94 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 105.916 -1.883 . . . . 25.0 105.916 173.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -148.07 128.54 14.02 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.72 0.267 . . . . 25.0 111.72 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -86.96 117.76 25.9 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 120.74 0.305 . . . . 25.0 110.859 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLN . . . . . 0.469 HE22 ' HA ' ' A' ' 3' ' ' TYR . 78.0 mt-30 -97.24 118.7 34.27 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 176.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -87.89 142.5 27.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.713 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.85 134.85 65.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 105.298 -2.112 . . . . 25.0 105.298 166.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.71 129.54 42.89 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 177.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -132.97 162.11 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 113.454 0.909 . . . . 25.0 113.454 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -117.89 95.11 4.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 104.56 -2.385 . . . . 25.0 104.56 168.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.14 163.66 14.76 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 112.397 0.517 . . . . 25.0 112.397 -173.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.3 p -145.74 162.95 36.42 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.896 -1.15 . . . . 25.0 107.896 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 117.96 -1.019 . . . . 25.0 110.879 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 21.5 m80 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 121.341 0.591 . . . . 25.0 110.602 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.43 164.46 30.52 Favored Glycine 0 C--N 1.321 -0.262 1 N-CA-C 99.904 -5.278 . . . . 25.0 99.904 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -145.6 162.03 38.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.968 2.384 . . . . 25.0 111.625 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.01 121.62 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 107.95 -1.129 . . . . 25.0 107.95 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -76.02 -42.78 46.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.456 -1.247 . . . . 25.0 109.809 -175.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.2 t -152.86 128.83 5.19 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 106.154 -1.795 . . . . 25.0 106.154 177.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.99 131.74 11.89 Favored 'Cis proline' 0 CA--C 1.534 0.483 0 C-N-CA 128.771 0.738 . . . . 25.0 111.193 -0.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.44 112.61 4.15 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 25.0 112.242 -171.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.9 t -71.97 157.82 37.12 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.378 -0.971 . . . . 25.0 108.378 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -56.12 -24.24 39.46 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.478 0.711 . . . . 25.0 111.826 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.7 -53.09 37.33 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.736 0.779 . . . . 25.0 109.337 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -66.86 -36.72 82.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.599 -0.728 . . . . 25.0 110.482 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -63.38 -31.02 72.07 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.985 -0.286 . . . . 25.0 110.755 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -40.63 95.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.192 0.52 . . . . 25.0 110.276 178.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.485 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.4 tmtm? -70.19 -33.55 71.86 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.04 0.448 . . . . 25.0 110.09 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -76.14 2.53 12.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.385 -0.37 . . . . 25.0 111.488 174.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 58.1 22.78 9.37 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.353 1.461 . . . . 25.0 113.093 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.8 mt -85.83 -21.86 27.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.148 -1.427 . . . . 25.0 107.148 173.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -123.89 159.08 30.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 177.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.9 p -136.72 175.96 9.14 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.881 -0.414 . . . . 25.0 109.881 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 72.62 5.22 5.19 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.523 1.675 . . . . 25.0 115.523 173.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -67.77 -36.51 80.62 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.671 -0.643 . . . . 25.0 111.282 173.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -63.25 1.67 Allowed Glycine 0 C--O 1.218 -0.858 0 O-C-N 123.552 0.532 . . . . 25.0 112.241 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -88.09 -53.86 4.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.5 1.143 . . . . 25.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.75 -7.15 7.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.401 -171.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.73 3.16 51.82 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.844 -0.535 . . . . 25.0 111.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -119.77 -33.99 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.272 -0.571 . . . . 25.0 110.911 173.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.98 107.46 22.07 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 107.746 -1.205 . . . . 25.0 107.746 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.485 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.7 Cg_endo -73.05 -19.23 23.24 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 116.276 -2.016 . . . . 25.0 114.389 -175.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -85.92 9.37 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.356 0.502 . . . . 25.0 112.356 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -61.4 -18.29 58.15 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.814 0.672 . . . . 25.0 112.814 178.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.4 m -65.29 124.21 19.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 114.721 1.378 . . . . 25.0 114.721 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -152.97 158.8 42.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.303 -1.74 . . . . 25.0 106.303 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.84 -166.57 18.99 Favored Glycine 0 N--CA 1.453 -0.172 0 N-CA-C 107.395 -2.282 . . . . 25.0 107.395 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.79 149.52 43.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 118.487 1.144 . . . . 25.0 112.31 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -67.03 156.93 34.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 107.126 -1.435 . . . . 25.0 107.126 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.18 -5.41 1.9 Allowed Glycine 0 C--N 1.318 -0.457 0 CA-C-N 114.953 -1.022 . . . . 25.0 112.394 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -75.97 145.85 78.15 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.25 -1.018 . . . . 25.0 108.25 -178.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -90.08 -19.99 13.05 Favored 'Cis proline' 0 CA--C 1.542 0.883 0 N-CA-C 115.859 1.446 . . . . 25.0 115.859 -4.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -71.08 -35.61 71.93 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.576 1.324 . . . . 25.0 114.576 -169.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.69 35.98 4.19 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.64 -1.985 . . . . 25.0 105.64 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -85.45 175.69 49.51 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.735 -1.121 . . . . 25.0 110.941 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.39 172.93 3.81 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 123.134 2.556 . . . . 25.0 113.616 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.0 30.99 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.203 -1.777 . . . . 25.0 106.203 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.71 139.56 57.83 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.504 -1.225 . . . . 25.0 107.725 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 -4.98 84.88 Favored Glycine 0 C--O 1.227 -0.316 0 C-N-CA 121.279 -0.486 . . . . 25.0 113.125 -174.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 55.1 m170 -124.82 10.28 8.3 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.349 -0.5 . . . . 25.0 109.816 177.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.1 mt -66.25 -45.27 90.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.31 -0.244 . . . . 25.0 110.903 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.44 -27.61 60.68 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.546 -0.539 . . . . 25.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.3 p -79.93 -7.66 58.89 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.459 0.911 . . . . 25.0 113.459 -176.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 35.53 18.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.582 0.753 . . . . 25.0 110.294 -173.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.8 OUTLIER 62.42 30.34 17.29 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.646 1.35 . . . . 25.0 114.646 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -117.51 137.33 52.62 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.828 -0.545 . . . . 25.0 111.992 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.99 -35.89 81.73 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 115.585 1.698 . . . . 25.0 115.585 -173.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.3 t -71.31 -4.87 28.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.522 0.564 . . . . 25.0 112.522 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.708 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.0 m-85 -123.39 11.9 9.36 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -73.57 -34.79 65.31 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.152 -0.968 . . . . 25.0 109.813 -176.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -71.61 -14.06 61.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.871 0.843 . . . . 25.0 109.419 175.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.708 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -90.46 -2.26 57.93 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.43 -32.19 6.0 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.312 0.577 . . . . 25.0 110.969 173.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.8 115.03 24.97 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 121.773 -0.579 . . . . 25.0 110.193 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -127.62 160.92 30.13 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.129 0.49 . . . . 25.0 110.027 176.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 33.0 p -119.87 162.45 33.03 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 100.384 -3.932 . . . . 25.0 100.384 162.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -70.12 -3.44 12.26 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 116.32 -1.987 . . . . 25.0 115.853 -175.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -122.37 7.74 9.62 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.656 0.741 . . . . 25.0 111.529 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -76.87 -28.54 55.45 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.345 -0.847 . . . . 25.0 113.204 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.481 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.3 m95 -126.92 167.23 16.14 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.741 0.305 . . . . 25.0 111.337 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -67.77 119.92 13.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.944 -1.873 . . . . 25.0 105.944 169.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.7 mmtt -95.43 105.24 17.19 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 100.507 -3.886 . . . . 25.0 100.507 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 135.32 54.6 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.664 -1.153 . . . . 25.0 110.291 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -92.0 101.73 14.28 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.173 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.6 mt -130.23 173.94 10.29 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.207 -1.034 . . . . 25.0 108.207 -175.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.85 157.33 22.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.364 -0.835 . . . . 25.0 111.224 -175.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 68.5 p -77.36 167.82 21.06 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.854 -1.535 . . . . 25.0 106.854 173.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.75 -161.87 23.97 Favored Glycine 0 C--O 1.241 0.543 0 N-CA-C 110.856 -0.897 . . . . 25.0 110.856 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.93 133.57 54.48 Favored 'Trans proline' 0 C--N 1.345 0.346 0 CA-C-N 118.989 1.394 . . . . 25.0 114.289 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -140.46 160.26 40.38 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.168 -1.79 . . . . 25.0 106.168 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 p -104.41 152.36 22.4 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 178.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -138.34 100.99 4.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 105.618 -1.993 . . . . 25.0 105.618 -178.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.86 119.21 38.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.876 0.846 . . . . 25.0 109.006 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.6 m95 -104.63 148.0 27.02 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.031 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -127.75 107.71 10.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.97 125.09 50.87 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 123.958 0.903 . . . . 25.0 112.187 -175.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -80.46 -20.22 44.27 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.297 -1.001 . . . . 25.0 108.297 168.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.85 108.62 16.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.85 -0.614 . . . . 25.0 111.586 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -77.63 0.57 22.72 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.869 1.433 . . . . 25.0 114.869 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -69.6 154.33 42.15 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.057 0.389 . . . . 25.0 110.21 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.5 t -70.57 155.91 40.11 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -171.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.2 t -97.78 159.37 14.97 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.281 -1.007 . . . . 25.0 108.281 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.5 t -117.77 -16.19 10.02 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 123.145 0.278 . . . . 25.0 111.322 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.5 t -172.13 153.24 3.05 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.991 0.424 . . . . 25.0 112.112 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.88 138.29 53.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 103.837 -2.653 . . . . 25.0 103.837 167.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -142.64 147.24 35.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -135.35 133.47 38.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -147.26 163.22 37.09 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.303 -0.628 . . . . 25.0 109.303 178.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.04 164.93 32.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 114.465 1.283 . . . . 25.0 114.465 -167.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.08 158.28 26.47 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 106.934 -1.506 . . . . 25.0 106.934 168.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -63.14 158.72 53.49 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.241 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.89 -20.55 38.92 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 116.681 -1.746 . . . . 25.0 114.252 -174.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -120.55 32.05 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.552 0.575 . . . . 25.0 112.552 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.499 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -71.89 165.51 24.0 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.932 0.873 . . . . 25.0 111.558 -179.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.04 101.01 10.84 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.725 -1.125 . . . . 25.0 109.706 -179.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.499 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.16 15.21 6.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.636 2.087 . . . . 25.0 116.636 -169.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.4 t -124.17 9.24 8.61 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -113.16 156.63 42.69 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 107.465 -1.309 . . . . 25.0 107.465 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.57 156.31 66.19 Favored 'Trans proline' 0 C--N 1.345 0.343 0 O-C-N 121.918 0.431 . . . . 25.0 112.016 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.52 104.24 3.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.187 0.517 . . . . 25.0 111.395 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.3 p -92.61 159.56 15.42 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -65.69 -25.97 67.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.159 0.504 . . . . 25.0 110.719 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.58 -22.48 60.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.481 -0.782 . . . . 25.0 112.745 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 21.2 m -77.39 -12.11 59.92 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.07 0.396 . . . . 25.0 112.07 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -99.77 158.35 15.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 114.555 1.317 . . . . 25.0 114.555 -175.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -96.02 98.23 10.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 102.38 -3.193 . . . . 25.0 102.38 161.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 74.8 mt -66.86 -7.62 23.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 115.003 1.483 . . . . 25.0 115.003 -169.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -83.8 131.37 52.1 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 108.706 -0.85 . . . . 25.0 108.706 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -72.54 150.44 51.38 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 115.15 -2.767 . . . . 25.0 111.047 177.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -102.25 -11.85 18.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.399 . . . . 25.0 111.603 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 64.0 m -149.84 66.87 0.99 Allowed 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 116.234 -0.439 . . . . 25.0 110.742 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -89.06 133.47 34.34 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.078 -1.049 . . . . 25.0 109.01 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -123.78 99.07 6.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 104.833 -2.284 . . . . 25.0 104.833 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.9 92.11 8.19 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.129 -1.434 . . . . 25.0 107.129 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -105.98 118.2 36.0 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.065 -1.457 . . . . 25.0 107.065 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.99 82.45 0.37 Allowed Glycine 0 CA--C 1.501 -0.826 0 CA-C-N 115.476 -0.784 . . . . 25.0 112.609 -170.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.4 13.99 6.06 Favored Glycine 0 C--N 1.32 -0.332 0 C-N-CA 120.998 -0.62 . . . . 25.0 113.357 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.49 104.0 5.04 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.514 0.673 . . . . 25.0 109.542 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 83.6 mt -73.57 124.5 90.42 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 106.367 -1.716 . . . . 25.0 106.367 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.47 158.74 53.28 Favored 'Trans proline' 0 C--N 1.345 0.384 0 N-CA-C 113.645 0.594 . . . . 25.0 113.645 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.48 28.66 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.81 -17.92 0.33 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.962 1.705 . . . . 25.0 111.508 -173.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' A' ' 128' ' ' ALA . 50.2 mt-30 -127.68 150.8 49.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 104.668 -2.345 . . . . 25.0 104.668 169.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 46.0 t -141.02 95.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 106.764 -1.569 . . . . 25.0 106.764 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.9 t -89.65 126.88 35.8 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 107.509 -1.293 . . . . 25.0 107.509 175.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.11 166.86 20.16 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 105.443 -2.058 . . . . 25.0 105.443 177.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -136.01 152.7 51.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 104.825 -2.287 . . . . 25.0 104.825 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.69 159.35 30.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.525 -0.917 . . . . 25.0 108.525 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -103.8 115.69 30.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.391 -0.368 . . . . 25.0 110.902 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.01 131.57 72.74 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 107.891 -1.151 . . . . 25.0 107.891 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.94 147.11 95.85 Favored 'Trans proline' 0 C--N 1.354 0.861 0 CA-C-O 121.642 0.601 . . . . 25.0 113.504 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.61 -26.77 37.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.132 -0.94 . . . . 25.0 112.745 -168.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -82.67 8.45 11.99 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.565 0.698 . . . . 25.0 110.321 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -114.5 51.87 0.87 Allowed 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.816 0.817 . . . . 25.0 109.144 173.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.7 p -85.98 163.33 18.05 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 93.6 -169.28 29.95 Favored Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 115.243 0.857 . . . . 25.0 115.243 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.05 108.33 18.21 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.358 0.599 . . . . 25.0 110.86 -168.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' HIS . . . . . 0.415 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 43.1 p-80 -157.39 169.44 24.72 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.86 -0.609 . . . . 25.0 112.015 -176.07 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.3 148.16 10.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 N-CA-C 108.427 -0.953 . . . . 25.0 108.427 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 65.7 mt -131.03 121.21 49.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 104.776 -2.305 . . . . 25.0 104.776 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.14 130.52 53.3 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.32 -0.855 . . . . 25.0 109.963 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.16 123.9 46.65 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.043 -0.725 . . . . 25.0 109.043 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.9 p -114.11 137.78 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.952 0.882 . . . . 25.0 111.653 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -112.09 118.99 36.92 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.933 -1.506 . . . . 25.0 106.933 176.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.71 126.45 45.75 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.745 -0.835 . . . . 25.0 108.745 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.3 mm -80.84 143.05 12.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 109.071 -0.714 . . . . 25.0 109.071 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.98 -45.98 17.47 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.724 0.693 . . . . 25.0 110.212 175.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -68.13 -22.55 64.87 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.45 1.278 . . . . 25.0 114.45 -172.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -137.45 168.52 19.48 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.965 0.888 . . . . 25.0 110.084 -174.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.41 21.4 0.62 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.097 -0.956 . . . . 25.0 112.533 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -93.62 146.34 23.89 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.024 0.75 . . . . 25.0 113.024 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.34 143.62 15.18 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.088 -2.19 . . . . 25.0 105.088 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -148.51 136.05 20.53 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.958 0.725 . . . . 25.0 112.958 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -92.0 113.99 26.42 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.199 0.599 . . . . 25.0 111.598 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.1 108.67 21.45 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.056 -0.72 . . . . 25.0 109.056 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.24 142.19 30.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.596 -0.729 . . . . 25.0 112.198 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.5 136.37 61.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.264 -2.125 . . . . 25.0 105.264 166.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -97.73 130.35 44.7 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 176.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.56 162.8 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 112.74 0.645 . . . . 25.0 112.74 -174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -118.25 95.04 4.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 104.348 -2.464 . . . . 25.0 104.348 167.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -89.99 163.72 14.82 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 112.242 0.46 . . . . 25.0 112.242 -171.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.6 p -143.42 154.96 44.24 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 176.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.135 -0.936 . . . . 25.0 111.086 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 48.6 m-70 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.891 0.377 . . . . 25.0 110.658 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.55 165.89 20.37 Favored Glycine 0 C--O 1.229 -0.167 1 N-CA-C 102.362 -4.295 . . . . 25.0 102.362 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -148.04 163.55 36.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 120.561 2.181 . . . . 25.0 111.916 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -100.2 123.36 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -77.8 -42.61 33.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.604 -1.18 . . . . 25.0 110.265 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -152.45 129.23 5.5 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.91 131.55 11.4 Favored 'Cis proline' 0 C--N 1.348 0.502 0 CA-C-N 118.83 0.618 . . . . 25.0 111.118 -0.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 109.87 2.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.931 -0.577 . . . . 25.0 112.15 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 t -72.03 157.55 37.59 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -56.09 -24.3 39.41 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.337 0.655 . . . . 25.0 111.985 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.12 -53.69 41.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.803 0.811 . . . . 25.0 109.262 175.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -67.11 -36.42 81.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 25.0 110.463 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -61.92 -32.55 72.96 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 121.106 -0.237 . . . . 25.0 111.028 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -40.84 97.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.306 0.574 . . . . 25.0 110.519 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.472 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.77 -33.04 70.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.066 0.46 . . . . 25.0 110.031 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.1 mt -76.12 5.4 6.83 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.425 -0.352 . . . . 25.0 111.777 175.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 62.9 14.82 7.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.621 1.168 . . . . 25.0 113.352 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.1 mt -84.06 -22.55 31.18 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.719 -0.845 . . . . 25.0 108.719 176.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -124.46 158.91 31.7 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 104.792 -2.299 . . . . 25.0 104.792 176.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.9 p -137.65 174.01 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.081 -0.341 . . . . 25.0 110.081 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 70.25 5.02 5.13 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 116.681 2.104 . . . . 25.0 116.681 176.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.7 m -64.57 -32.33 73.94 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 121.916 -0.49 . . . . 25.0 110.388 172.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 -63.08 1.79 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.818 0.699 . . . . 25.0 112.023 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.6 t -88.06 -53.48 4.7 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.611 1.196 . . . . 25.0 111.587 -178.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.6 t -68.1 -12.72 16.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.376 -1.284 . . . . 25.0 112.931 -171.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -84.69 -0.82 54.89 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 121.852 -0.53 . . . . 25.0 111.865 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -117.56 -34.16 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.047 -0.661 . . . . 25.0 110.376 172.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.04 104.67 22.63 Favored Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 109.531 -0.544 . . . . 25.0 109.531 171.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.472 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.6 Cg_endo -74.89 -19.78 17.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 116.758 -1.695 . . . . 25.0 113.963 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -86.37 12.85 9.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.934 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -66.48 -14.0 61.62 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.754 0.312 . . . . 25.0 111.613 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 19.4 m -64.02 129.23 27.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 113.839 1.051 . . . . 25.0 113.839 -177.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -152.93 152.4 31.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.383 -1.34 . . . . 25.0 107.383 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.86 -172.96 27.74 Favored Glycine 0 N--CA 1.455 -0.094 0 N-CA-C 108.843 -1.703 . . . . 25.0 108.843 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.0 148.27 47.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 118.426 1.113 . . . . 25.0 111.827 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.14 156.92 32.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.12 -1.437 . . . . 25.0 107.12 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.42 2.13 2.99 Favored Glycine 0 C--N 1.318 -0.45 0 CA-C-N 114.929 -1.032 . . . . 25.0 112.919 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -75.91 141.39 71.52 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -93.0 -13.46 20.96 Favored 'Cis proline' 0 CA--C 1.543 0.948 0 C-N-CA 130.474 1.447 . . . . 25.0 115.469 -6.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.88 -37.07 75.93 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.483 1.29 . . . . 25.0 114.483 -169.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.01 30.91 6.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.251 -2.129 . . . . 25.0 105.251 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.98 179.05 43.92 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.899 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -62.6 173.0 3.91 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.743 2.295 . . . . 25.0 113.628 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.01 30.99 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -60.54 140.02 57.52 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 107.001 -1.481 . . . . 25.0 107.001 174.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.03 -5.01 78.42 Favored Glycine 0 N--CA 1.459 0.176 0 CA-C-O 121.817 0.676 . . . . 25.0 112.583 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -126.03 8.4 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.998 -0.741 . . . . 25.0 108.998 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.94 -52.76 49.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 122.308 -0.245 . . . . 25.0 111.637 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.57 -21.11 59.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.372 -0.603 . . . . 25.0 109.372 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.0 p -81.86 -7.62 59.62 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.597 0.592 . . . . 25.0 112.597 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.29 31.19 11.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.512 0.725 . . . . 25.0 110.33 -173.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.57 36.58 25.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.715 1.376 . . . . 25.0 114.715 -176.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -120.73 136.29 54.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.992 0.517 . . . . 25.0 110.585 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.08 -33.89 75.27 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 115.234 1.568 . . . . 25.0 115.234 -174.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 55' ' ' THR . 1.5 t -71.12 -7.15 44.62 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.622 0.601 . . . . 25.0 112.622 -178.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.67 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.7 m-85 -120.84 13.09 11.43 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -71.37 -37.23 71.64 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.243 -0.91 . . . . 25.0 111.338 -176.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -69.82 -17.98 63.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.294 1.045 . . . . 25.0 108.757 177.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.67 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -85.51 -8.19 58.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.081 -0.963 . . . . 25.0 109.174 -177.384 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -113.12 -36.13 5.16 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.671 1.36 . . . . 25.0 114.671 176.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -104.92 125.94 51.46 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.102 -0.999 . . . . 25.0 110.821 -176.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.5 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.4 pm0 -127.73 161.05 29.84 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.286 -1.325 . . . . 25.0 110.029 -176.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -112.6 162.66 20.54 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 100.663 -3.829 . . . . 25.0 100.663 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -70.45 -0.14 7.04 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 N-CA-C 116.129 1.55 . . . . 25.0 116.129 -174.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -127.92 13.64 6.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.587 0.708 . . . . 25.0 110.251 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -30.48 45.19 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.825 1.046 . . . . 25.0 113.825 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.5 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 15.8 m95 -126.77 167.89 15.16 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.599 -0.519 . . . . 25.0 109.599 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -66.46 126.89 30.27 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.246 -1.761 . . . . 25.0 106.246 171.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -98.97 106.19 18.42 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 100.543 -3.873 . . . . 25.0 100.543 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.63 134.66 52.77 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.06 -0.973 . . . . 25.0 110.259 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -91.69 100.66 13.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.691 -1.14 . . . . 25.0 108.021 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.5 mt -131.89 173.96 10.65 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.135 -1.061 . . . . 25.0 108.135 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.78 156.38 23.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.944 -176.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 139' ' ' ALA . 53.3 p -77.13 167.9 20.99 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.163 -1.421 . . . . 25.0 107.163 172.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.26 -160.78 23.04 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 110.518 -1.033 . . . . 25.0 110.518 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.87 132.98 50.81 Favored 'Trans proline' 0 C--N 1.345 0.387 0 CA-C-N 119.202 1.501 . . . . 25.0 114.079 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.31 161.98 36.39 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.7 p -101.52 150.86 22.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.829 -1.175 . . . . 25.0 107.829 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -137.66 100.96 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.98 121.46 45.41 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 123.923 0.889 . . . . 25.0 109.52 -177.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -107.36 152.18 24.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.035 -0.984 . . . . 25.0 110.161 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -129.35 114.54 16.33 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 104.789 -2.3 . . . . 25.0 104.789 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.8 mp -115.05 117.87 31.8 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.193 -173.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -81.91 6.58 15.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.302 0.572 . . . . 25.0 111.272 173.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -122.62 132.32 54.23 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.979 -0.451 . . . . 25.0 110.345 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -80.63 -9.63 59.78 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.874 0.694 . . . . 25.0 112.874 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.15 155.58 31.16 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.19 0.441 . . . . 25.0 112.19 -176.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 t -76.99 155.89 32.3 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.819 0.818 . . . . 25.0 112.859 -175.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.463 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 6.6 t -97.92 158.24 15.64 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.502 -1.296 . . . . 25.0 107.502 173.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -117.92 -15.6 9.98 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.102 0.251 . . . . 25.0 111.195 172.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -171.99 150.25 2.52 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.312 0.486 . . . . 25.0 112.312 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -123.94 138.54 54.45 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.457 -2.423 . . . . 25.0 104.457 167.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.6 mtt-85 -137.27 144.76 42.87 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -137.94 127.52 25.05 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.686 -1.598 . . . . 25.0 106.686 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -147.74 168.76 21.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.675 -0.861 . . . . 25.0 108.675 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.51 167.38 26.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 113.394 0.887 . . . . 25.0 113.394 -168.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.3 p -79.06 160.53 27.07 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.735 . . . . 25.0 106.317 167.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -62.13 159.0 41.66 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.708 -0.678 . . . . 25.0 109.553 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.26 -24.53 37.6 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 116.923 -1.584 . . . . 25.0 113.056 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -115.02 32.06 6.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.092 0.557 . . . . 25.0 110.762 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -72.68 165.42 24.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.135 0.969 . . . . 25.0 113.577 -174.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -83.17 101.04 10.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.377 -1.283 . . . . 25.0 110.293 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.93 7.99 28.34 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 117.715 2.487 . . . . 25.0 117.715 -168.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.0 t -123.44 8.32 9.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.778 0.799 . . . . 25.0 109.231 176.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -107.25 160.52 26.18 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 114.541 -1.209 . . . . 25.0 108.916 -172.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -64.53 152.51 81.42 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 118.051 -0.833 . . . . 25.0 111.412 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -71.59 100.14 2.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.498 0.666 . . . . 25.0 110.868 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -88.96 153.97 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.503 -1.295 . . . . 25.0 107.503 176.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.21 -25.93 68.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.257 0.551 . . . . 25.0 111.167 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.47 61.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.333 -0.849 . . . . 25.0 112.801 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.4 t -79.29 -3.93 48.36 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.196 0.443 . . . . 25.0 112.196 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -106.01 155.58 19.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -96.47 91.24 5.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 101.952 -3.351 . . . . 25.0 101.952 161.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.82 -7.11 37.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -171.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.39 119.6 77.79 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.862 -1.162 . . . . 25.0 107.862 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -72.09 143.27 39.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 114.998 -2.868 . . . . 25.0 112.416 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -95.0 -14.59 24.22 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.064 0.394 . . . . 25.0 112.064 -176.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 75.1 m -147.94 62.77 1.12 Allowed 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.827 0.306 . . . . 25.0 111.827 178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -88.96 139.46 30.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 118.24 -1.384 . . . . 25.0 108.705 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -124.92 99.12 5.99 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -92.47 92.12 7.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.016 -1.476 . . . . 25.0 107.016 -176.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -106.15 117.9 35.24 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.438 -0.949 . . . . 25.0 108.438 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -96.92 77.88 0.69 Allowed Glycine 0 CA--C 1.504 -0.628 0 CA-C-N 115.45 -0.795 . . . . 25.0 114.023 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.93 20.39 5.3 Favored Glycine 0 C--N 1.321 -0.275 0 C-N-CA 120.882 -0.675 . . . . 25.0 113.862 178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.38 105.13 5.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.497 0.665 . . . . 25.0 109.828 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.24 125.99 91.24 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 105.563 -2.014 . . . . 25.0 105.563 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.5 169.14 23.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 118.369 -0.621 . . . . 25.0 113.598 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.22 31.49 4.26 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.372 -1.344 . . . . 25.0 107.372 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.66 -17.94 0.27 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.94 1.696 . . . . 25.0 112.132 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.9 mt-30 -129.25 155.47 45.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 104.703 -2.332 . . . . 25.0 104.703 171.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.1 t -140.72 95.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.417 -2.068 . . . . 25.0 105.417 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.9 t -95.52 142.58 27.7 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -156.95 167.03 31.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 113.709 -1.587 . . . . 25.0 108.628 -175.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -129.77 156.89 43.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.88 -1.526 . . . . 25.0 106.88 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.12 161.35 31.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.483 -1.302 . . . . 25.0 107.483 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -105.09 117.16 33.3 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.085 0.241 . . . . 25.0 111.101 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.54 132.25 69.48 Favored Pre-proline 0 CA--C 1.541 0.628 0 N-CA-C 107.888 -1.152 . . . . 25.0 107.888 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -61.26 145.75 98.14 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-O 121.705 0.627 . . . . 25.0 113.472 -179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.429 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.62 -25.64 35.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.178 -0.919 . . . . 25.0 112.665 -168.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -84.24 9.77 12.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.611 0.719 . . . . 25.0 110.212 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -115.18 53.55 0.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.345 -0.983 . . . . 25.0 108.345 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.9 p -86.12 165.45 16.59 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 106.748 -1.575 . . . . 25.0 106.748 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.14 -167.08 32.68 Favored Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 115.368 0.907 . . . . 25.0 115.368 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.7 t -86.0 108.13 18.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.959 0.409 . . . . 25.0 110.799 -168.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 38.5 p-80 -158.53 168.39 27.04 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 113.816 1.043 . . . . 25.0 113.816 -174.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 16.1 t -100.91 146.24 9.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.376 -0.972 . . . . 25.0 108.376 -179.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.81 129.65 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 102.114 -3.291 . . . . 25.0 102.114 179.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.44 132.57 54.98 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.522 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -113.09 111.88 22.88 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -106.31 142.19 19.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.356 0.598 . . . . 25.0 110.087 -176.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.463 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 18.2 t90 -123.63 124.31 42.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.0 -1.0 . . . . 25.0 108.608 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -105.21 129.46 53.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.998 -0.742 . . . . 25.0 108.998 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.2 mm -85.97 141.11 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.313 -0.625 . . . . 25.0 109.313 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.78 20.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.714 0.688 . . . . 25.0 110.528 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -23.33 64.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.077 1.14 . . . . 25.0 114.077 -171.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.5 p -138.39 169.9 16.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 122.046 0.926 . . . . 25.0 110.32 -174.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.97 19.05 0.73 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.999 -1.0 . . . . 25.0 112.325 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -90.3 147.62 23.38 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.66 -0.65 . . . . 25.0 112.528 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.05 144.67 19.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 104.414 -2.439 . . . . 25.0 104.414 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -143.43 147.94 35.37 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.721 0.237 . . . . 25.0 110.51 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -109.4 107.76 18.04 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.856 0.863 . . . . 25.0 109.666 -174.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.13 20.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.189 0.519 . . . . 25.0 110.142 -177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.56 145.93 26.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.953 -0.567 . . . . 25.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.87 147.09 32.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 103.782 -2.673 . . . . 25.0 103.782 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -110.75 130.64 55.52 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.241 -1.762 . . . . 25.0 106.241 176.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.0 m -132.76 162.45 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.738 0.644 . . . . 25.0 112.738 -173.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -117.98 95.12 4.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 104.336 -2.468 . . . . 25.0 104.336 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.89 163.99 13.83 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 112.919 0.711 . . . . 25.0 112.919 -171.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.4 p -144.74 164.43 31.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.977 -1.12 . . . . 25.0 107.977 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.839 0 CA-C-O 117.592 -1.194 . . . . 25.0 111.959 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.1 m170 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.332 -0.248 . . . . 25.0 110.332 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.33 165.14 33.04 Favored Glycine 0 CA--C 1.509 -0.284 1 N-CA-C 102.887 -4.085 . . . . 25.0 102.887 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -145.78 158.4 43.86 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 119.668 1.734 . . . . 25.0 110.984 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.15 119.56 34.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.72 -43.15 48.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.279 -1.328 . . . . 25.0 109.319 -174.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.8 t -155.37 128.38 4.26 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -63.9 128.52 7.13 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 C-N-CA 129.706 1.128 . . . . 25.0 112.346 0.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.75 116.83 8.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.777 0.658 . . . . 25.0 112.777 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.4 t -72.11 157.84 37.02 Favored 'General case' 0 C--O 1.216 -0.665 0 N-CA-C 109.011 -0.737 . . . . 25.0 109.011 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.93 -25.12 41.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.602 0.761 . . . . 25.0 111.656 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -52.76 44.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.755 0.788 . . . . 25.0 109.155 175.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.94 -36.72 84.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 25.0 110.308 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -63.65 -33.74 76.29 Favored 'General case' 0 C--O 1.219 -0.531 0 O-C-N 122.223 -0.298 . . . . 25.0 110.899 178.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -40.26 96.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.342 0.591 . . . . 25.0 109.915 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.423 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 6.3 tmtm? -68.45 -33.85 74.92 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.212 0.529 . . . . 25.0 110.311 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.5 mt -79.08 5.14 12.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 25.0 111.276 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 58.7 24.77 12.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.177 1.391 . . . . 25.0 112.909 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -89.7 -21.44 22.72 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.914 -1.143 . . . . 25.0 107.914 174.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -123.51 160.28 27.3 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 105.669 -1.974 . . . . 25.0 105.669 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 42.6 p -134.31 175.13 9.78 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 122.449 0.3 . . . . 25.0 110.456 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 69.39 5.23 5.03 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.877 1.806 . . . . 25.0 115.877 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -66.67 -38.52 86.99 Favored 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 121.344 -0.848 . . . . 25.0 111.145 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -63.33 1.54 Allowed Glycine 0 C--O 1.218 -0.9 0 O-C-N 123.55 0.531 . . . . 25.0 112.449 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -53.73 4.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.549 1.166 . . . . 25.0 111.806 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -7.03 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.603 -1.18 . . . . 25.0 113.63 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.419 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.6 pt20 -88.27 2.0 53.32 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.8 -0.563 . . . . 25.0 111.102 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -117.65 -34.05 4.36 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.742 -0.383 . . . . 25.0 110.791 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -126.93 107.62 22.2 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 172.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.423 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 84.1 Cg_endo -76.9 -18.55 14.71 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 116.867 -1.622 . . . . 25.0 113.797 -171.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -90.66 12.01 20.34 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.64 0.607 . . . . 25.0 112.64 -177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.0 m -62.18 -17.93 59.5 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.092 0.472 . . . . 25.0 112.121 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.418 ' H ' HG22 ' A' ' 32' ' ' VAL . 2.2 m -64.1 120.65 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.81 0.814 . . . . 25.0 112.695 -179.301 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -152.99 156.5 38.96 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.56 -169.05 24.34 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -176.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.7 tp -118.18 147.77 43.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.216 1.008 . . . . 25.0 111.917 -176.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.46 156.88 31.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 172.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 139.95 1.69 1.76 Allowed Glycine 0 C--O 1.223 -0.536 0 CA-C-N 114.768 -1.105 . . . . 25.0 113.195 179.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -75.99 139.07 69.07 Favored Pre-proline 0 C--N 1.321 -0.655 0 O-C-N 121.569 -0.959 . . . . 25.0 109.631 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.2 -13.13 21.23 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 C-N-CA 130.438 1.433 . . . . 25.0 115.509 -6.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -71.63 -36.76 70.86 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -168.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.69 31.95 5.74 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.26 -174.42 42.05 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.336 -1.302 . . . . 25.0 110.859 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -61.96 170.26 6.33 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.446 2.097 . . . . 25.0 113.097 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 159.97 31.12 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 106.592 -1.633 . . . . 25.0 106.592 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.62 138.84 58.01 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.563 -1.199 . . . . 25.0 108.34 177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.36 -4.12 82.46 Favored Glycine 0 C--O 1.227 -0.296 0 C-N-CA 121.216 -0.516 . . . . 25.0 112.844 -174.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -124.45 9.08 8.42 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.656 -0.868 . . . . 25.0 108.656 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.79 -47.27 86.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 O-C-N 122.405 -0.185 . . . . 25.0 110.906 -172.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.02 -18.46 58.13 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.024 -0.423 . . . . 25.0 110.182 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 p -87.97 -7.17 57.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.41 32.81 11.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.659 0.784 . . . . 25.0 110.412 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.96 37.08 24.69 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -177.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -120.7 137.28 54.55 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.124 0.569 . . . . 25.0 111.11 175.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.7 p -62.62 -35.43 79.54 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.378 1.621 . . . . 25.0 115.378 -174.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -71.56 -6.97 44.68 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.615 0.598 . . . . 25.0 112.615 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.684 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.6 m-85 -120.44 11.91 11.51 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 107.32 -1.363 . . . . 25.0 107.32 -179.433 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.62 -34.47 67.35 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.051 -1.031 . . . . 25.0 110.084 -175.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -71.27 -15.56 62.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.947 0.879 . . . . 25.0 109.945 174.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.684 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.91 -6.48 58.04 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 -177.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.55 -32.36 6.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.097 0.475 . . . . 25.0 111.81 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -98.15 121.91 40.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 121.743 -0.598 . . . . 25.0 110.052 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -129.68 160.97 31.69 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.022 -0.733 . . . . 25.0 109.022 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.7 p -115.79 162.39 25.64 Favored Pre-proline 0 C--N 1.321 -0.666 1 N-CA-C 100.108 -4.034 . . . . 25.0 100.108 162.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.9 -4.9 14.34 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 116.744 -1.704 . . . . 25.0 115.586 -175.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -125.15 10.7 8.13 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.079 0.466 . . . . 25.0 111.783 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -77.72 -30.14 51.59 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.657 -0.652 . . . . 25.0 112.593 -176.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 10.4 m95 -125.07 164.7 19.63 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.85 -0.426 . . . . 25.0 109.85 -178.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -66.83 129.15 38.95 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 171.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -100.9 105.54 16.81 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 100.694 -3.817 . . . . 25.0 100.694 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.9 mp -68.54 136.31 52.92 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.12 -0.946 . . . . 25.0 110.784 -176.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -88.26 111.92 22.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.915 -1.039 . . . . 25.0 108.856 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.1 mt -137.09 173.19 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.143 -1.058 . . . . 25.0 108.143 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.22 156.3 25.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.704 -0.68 . . . . 25.0 110.467 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.442 HG21 ' HA ' ' A' ' 139' ' ' ALA . 70.5 p -76.95 170.47 16.45 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 173.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 92.44 -161.87 26.54 Favored Glycine 0 C--O 1.239 0.456 0 CA-C-O 118.95 -0.917 . . . . 25.0 110.95 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -58.94 131.2 40.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 CA-C-N 119.149 1.475 . . . . 25.0 113.517 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -139.26 163.11 33.33 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.093 -1.447 . . . . 25.0 107.093 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.8 p -104.17 152.45 22.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.03 -1.1 . . . . 25.0 108.03 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -140.62 101.09 4.01 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 104.917 -2.253 . . . . 25.0 104.917 -177.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.98 134.98 49.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -120.35 153.21 36.79 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.962 -1.472 . . . . 25.0 109.542 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -130.44 117.25 19.39 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 104.21 -2.515 . . . . 25.0 104.21 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.9 137.64 52.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.139 -0.937 . . . . 25.0 111.22 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.8 t -92.75 2.36 56.78 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.984 0.421 . . . . 25.0 111.219 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -128.57 139.46 52.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.932 0.396 . . . . 25.0 111.142 -177.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.3 mmm-85 -92.06 1.77 56.99 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.895 -0.593 . . . . 25.0 112.49 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.25 148.81 49.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.591 -0.444 . . . . 25.0 110.083 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.4 t -71.8 155.93 39.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.078 1.14 . . . . 25.0 114.078 -170.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.448 HG21 ' HE1' ' A' ' 92' ' ' TRP . 14.8 t -99.03 159.45 14.95 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.179 -1.045 . . . . 25.0 108.179 173.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -117.96 -13.75 10.03 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.125 0.266 . . . . 25.0 110.589 170.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.62 151.87 2.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.803 0.335 . . . . 25.0 111.325 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.448 ' HE1' HG21 ' A' ' 89' ' ' THR . 63.1 m95 -122.72 141.51 51.71 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.274 -2.491 . . . . 25.0 104.274 165.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -145.34 152.98 40.74 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.727 -1.212 . . . . 25.0 107.727 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -136.71 134.81 37.58 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.786 -1.931 . . . . 25.0 105.786 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.59 165.23 31.0 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.196 0.453 . . . . 25.0 109.822 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.01 167.83 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 113.713 1.005 . . . . 25.0 113.713 -166.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.9 p -82.25 163.78 21.62 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.235 -1.024 . . . . 25.0 108.235 168.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.39 159.38 41.26 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.349 -0.842 . . . . 25.0 109.355 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.87 -24.23 34.2 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 116.063 -2.158 . . . . 25.0 113.581 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -115.58 31.87 6.43 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 122.915 0.486 . . . . 25.0 111.069 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' TRP . . . . . 0.495 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 7.0 p-90 -71.98 166.57 21.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.13 0.967 . . . . 25.0 112.524 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.06 101.04 10.87 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.51 -1.223 . . . . 25.0 109.212 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.495 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.11 15.13 10.76 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 116.041 1.867 . . . . 25.0 116.041 -169.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -128.1 13.2 6.71 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.701 -0.852 . . . . 25.0 108.701 176.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -117.54 157.24 48.11 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.521 -1.218 . . . . 25.0 107.976 -174.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -64.93 153.2 79.33 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 O-C-N 121.961 0.453 . . . . 25.0 111.798 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.63 103.77 4.34 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.58 0.705 . . . . 25.0 112.308 -175.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 19.9 p -98.02 161.41 13.74 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.157 -0.683 . . . . 25.0 109.157 177.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -68.03 -23.39 64.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.234 0.54 . . . . 25.0 111.029 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.69 63.4 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.212 -0.904 . . . . 25.0 112.034 176.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.3 m -85.65 -9.73 56.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.115 0.483 . . . . 25.0 111.415 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -95.54 154.58 17.13 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 114.363 1.245 . . . . 25.0 114.363 -177.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -97.74 94.27 6.85 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 102.512 -3.144 . . . . 25.0 102.512 161.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.47 -7.51 20.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.569 1.322 . . . . 25.0 114.569 -170.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -81.79 132.47 54.43 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.061 -0.718 . . . . 25.0 109.061 177.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -72.66 150.92 51.54 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 115.01 -2.86 . . . . 25.0 110.615 176.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -102.32 -9.84 20.01 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.961 0.41 . . . . 25.0 111.17 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 47.7 m -151.86 70.82 0.95 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 25.0 109.793 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.08 135.14 33.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.06 -1.056 . . . . 25.0 108.964 176.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -121.22 99.1 6.3 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.168 -2.901 . . . . 25.0 103.168 177.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -90.32 91.93 8.7 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -113.68 118.44 34.36 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 107.763 -1.199 . . . . 25.0 107.763 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.32 83.71 0.38 Allowed Glycine 0 CA--C 1.5 -0.874 0 CA-C-N 115.311 -0.859 . . . . 25.0 112.564 -170.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.33 14.04 6.64 Favored Glycine 0 C--N 1.32 -0.313 0 C-N-CA 121.054 -0.593 . . . . 25.0 113.253 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.31 105.56 5.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.58 0.705 . . . . 25.0 109.334 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -74.39 121.62 85.64 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 107.039 -1.467 . . . . 25.0 107.039 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -72.32 162.89 40.28 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 118.267 -0.689 . . . . 25.0 112.933 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -100.14 27.58 5.51 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.665 -0.865 . . . . 25.0 108.665 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.03 -9.79 0.82 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.604 1.561 . . . . 25.0 111.676 -174.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -132.26 151.81 51.65 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 103.49 -2.782 . . . . 25.0 103.49 170.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 49.4 t -142.03 95.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.638 . . . . 25.0 106.576 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -90.99 138.36 31.67 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.49 164.93 30.97 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 106.287 -1.746 . . . . 25.0 106.287 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -136.46 149.01 48.01 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.962 -2.236 . . . . 25.0 104.962 174.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 160.94 31.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.328 -1.36 . . . . 25.0 107.328 -176.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -101.16 118.44 36.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.528 0.204 . . . . 25.0 111.368 -177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.3 mt -78.94 132.64 63.35 Favored Pre-proline 0 CA--C 1.541 0.625 0 N-CA-C 107.831 -1.174 . . . . 25.0 107.831 176.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -61.52 146.84 96.64 Favored 'Trans proline' 0 C--N 1.355 0.872 0 CA-C-O 121.611 0.588 . . . . 25.0 113.492 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.442 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.84 -26.83 33.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.162 -0.927 . . . . 25.0 112.56 -169.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -84.35 9.48 13.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.582 -0.736 . . . . 25.0 110.376 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -113.32 52.98 0.78 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.677 -0.86 . . . . 25.0 108.677 171.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.1 p -85.99 161.72 18.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.48 -165.41 31.14 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 115.562 0.985 . . . . 25.0 115.562 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.1 t -85.82 109.05 18.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.443 0.64 . . . . 25.0 111.267 -168.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.5 p-80 -158.31 171.51 20.04 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.777 -0.647 . . . . 25.0 110.379 -176.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.37 150.64 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.5 mt -132.99 129.29 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 N-CA-C 101.478 -3.527 . . . . 25.0 101.478 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 137.53 53.58 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.102 -0.499 . . . . 25.0 109.78 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -119.02 134.68 55.04 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 109.561 -0.533 . . . . 25.0 109.561 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -124.52 140.09 48.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.126 0.965 . . . . 25.0 111.762 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -111.44 109.7 19.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 113.495 -1.684 . . . . 25.0 106.675 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -91.08 121.5 32.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.431 -1.322 . . . . 25.0 107.431 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.2 mm -79.65 141.75 14.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.528 -0.545 . . . . 25.0 109.528 -178.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.33 -42.14 23.51 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.699 0.681 . . . . 25.0 110.163 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.0 -24.72 65.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.592 0.96 . . . . 25.0 113.592 -172.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 63.5 p -139.53 169.52 17.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.938 0.875 . . . . 25.0 110.084 -174.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.04 23.67 0.55 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.193 -0.912 . . . . 25.0 112.295 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -92.77 146.28 23.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.991 0.738 . . . . 25.0 112.991 -176.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.25 143.12 10.35 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.785 -1.932 . . . . 25.0 105.785 172.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -148.77 132.87 17.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 111.676 0.25 . . . . 25.0 111.676 178.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.12 114.9 26.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.414 0.446 . . . . 25.0 110.821 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -97.11 108.14 20.81 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.65 -0.87 . . . . 25.0 108.65 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.26 139.9 35.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.236 -0.893 . . . . 25.0 113.201 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -125.98 132.69 70.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.998 -1.853 . . . . 25.0 105.998 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -91.39 130.28 37.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.377 -1.342 . . . . 25.0 107.377 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.83 162.19 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.941 0.719 . . . . 25.0 112.941 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -119.95 95.64 4.85 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 104.47 -2.418 . . . . 25.0 104.47 168.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.41 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.03 163.23 14.99 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.483 0.549 . . . . 25.0 112.483 -172.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.2 p -143.36 156.31 44.65 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.944 -1.132 . . . . 25.0 107.944 176.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.013 -0.994 . . . . 25.0 111.466 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.8 m80 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.951 0.405 . . . . 25.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.89 177.27 33.86 Favored Glycine 0 CA--C 1.508 -0.352 1 N-CA-C 101.928 -4.469 . . . . 25.0 101.928 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -145.84 163.95 33.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 119.973 1.886 . . . . 25.0 109.689 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -100.74 122.01 52.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 106.497 -1.668 . . . . 25.0 106.497 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.23 -42.37 59.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.634 -1.166 . . . . 25.0 109.684 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.7 t -153.53 130.18 5.63 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 105.653 -1.98 . . . . 25.0 105.653 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -65.2 132.13 14.46 Favored 'Cis proline' 0 C--N 1.346 0.433 0 CA-C-N 118.783 0.601 . . . . 25.0 111.09 -0.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.37 111.14 3.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.074 -0.512 . . . . 25.0 111.887 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 t -72.21 157.52 37.58 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 109.06 -0.718 . . . . 25.0 109.06 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.44 -24.66 31.82 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.625 0.77 . . . . 25.0 111.757 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.07 -54.61 23.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.933 0.873 . . . . 25.0 109.52 176.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.23 -37.18 84.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.175 -0.921 . . . . 25.0 110.204 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -62.52 -33.29 74.59 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 122.313 -0.242 . . . . 25.0 110.963 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -39.39 93.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.011 0.434 . . . . 25.0 110.725 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.04 -35.49 74.33 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.183 0.516 . . . . 25.0 109.669 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.1 mt -74.58 2.61 9.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.162 -0.472 . . . . 25.0 111.561 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 58.19 23.39 10.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.413 1.485 . . . . 25.0 112.926 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 19' ' ' ASN . 90.0 mt -84.96 -21.82 29.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 173.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.446 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -124.02 158.75 31.4 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.243 -2.132 . . . . 25.0 105.243 176.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 p -136.94 176.59 8.57 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.431 -0.581 . . . . 25.0 109.431 -177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 70.51 4.93 5.16 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.579 1.696 . . . . 25.0 115.579 174.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -67.83 -32.54 73.15 Favored 'General case' 0 CA--C 1.496 -1.113 0 O-C-N 121.354 -0.841 . . . . 25.0 110.563 172.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.19 -63.58 1.34 Allowed Glycine 0 C--O 1.215 -1.063 0 O-C-N 123.923 0.765 . . . . 25.0 112.151 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.6 t -88.08 -52.59 5.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.366 1.079 . . . . 25.0 112.343 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -65.97 -15.29 18.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.57 -1.196 . . . . 25.0 112.849 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HG2' ' H ' ' A' ' 26' ' ' GLN . 14.6 pt20 -84.33 -3.03 58.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.916 -0.49 . . . . 25.0 111.464 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -117.21 -35.65 3.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.182 -0.607 . . . . 25.0 110.264 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -127.0 94.06 40.33 Favored Pre-proline 0 C--O 1.243 0.76 0 N-CA-C 111.83 0.308 . . . . 25.0 111.83 171.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.2 Cg_endo -74.02 -20.64 19.13 Favored 'Trans proline' 0 C--N 1.346 0.396 0 N-CA-C 115.121 1.162 . . . . 25.0 115.121 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -83.74 9.34 12.04 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.851 -0.531 . . . . 25.0 112.123 -177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.8 m -66.65 -16.05 63.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.789 0.663 . . . . 25.0 112.789 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.6 m -63.97 125.35 20.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.759 1.022 . . . . 25.0 113.759 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -152.95 153.64 33.39 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 105.891 -1.892 . . . . 25.0 105.891 178.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.4 -167.66 16.69 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 108.891 -1.684 . . . . 25.0 108.891 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.0 tp -123.92 142.04 51.5 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.261 1.03 . . . . 25.0 111.506 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.07 157.0 29.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.822 -1.177 . . . . 25.0 107.822 172.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 132.19 6.98 2.97 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 114.804 -1.089 . . . . 25.0 113.507 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -75.77 139.65 70.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 O-C-N 121.564 -0.963 . . . . 25.0 108.889 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -91.87 -15.56 18.95 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 N-CA-C 115.826 1.433 . . . . 25.0 115.826 -5.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -69.18 -36.71 77.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.15 1.537 . . . . 25.0 115.15 -169.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.14 30.28 7.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.641 -1.985 . . . . 25.0 105.641 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.36 -178.0 42.95 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.397 -1.274 . . . . 25.0 110.824 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -62.1 171.75 4.76 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 122.957 2.438 . . . . 25.0 113.391 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.92 160.02 31.12 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.8 -1.556 . . . . 25.0 106.8 173.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.73 138.7 58.07 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 107.694 -1.224 . . . . 25.0 107.694 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.68 -4.71 81.36 Favored Glycine 0 CA--C 1.51 -0.258 0 C-N-CA 121.267 -0.492 . . . . 25.0 113.045 -174.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -124.01 10.02 8.78 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.74 -0.837 . . . . 25.0 108.74 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.68 -49.77 75.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.716 -0.22 . . . . 25.0 111.516 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.07 -21.47 56.71 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.813 -0.554 . . . . 25.0 109.732 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.6 p -82.75 -8.01 59.62 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.565 0.58 . . . . 25.0 112.565 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.19 33.49 12.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.594 0.757 . . . . 25.0 110.547 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.16 39.12 26.3 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.838 1.422 . . . . 25.0 114.838 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -121.38 135.46 55.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.025 -0.534 . . . . 25.0 110.654 175.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -62.24 -34.4 76.45 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 115.05 1.5 . . . . 25.0 115.05 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -70.66 -11.48 60.97 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.341 0.591 . . . . 25.0 112.275 -178.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -115.42 13.12 16.45 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 107.474 -1.306 . . . . 25.0 107.474 -178.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -70.74 -37.11 73.43 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.015 -1.053 . . . . 25.0 110.7 -175.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.9 mp0 -69.42 -15.3 63.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.746 0.784 . . . . 25.0 110.421 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.94 -7.67 57.96 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -113.2 -33.54 5.95 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.423 0.527 . . . . 25.0 112.423 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -94.31 121.68 36.08 Favored 'General case' 0 CA--C 1.505 -0.774 0 O-C-N 121.602 -0.686 . . . . 25.0 109.697 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.423 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -129.41 161.0 31.37 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.57 -0.741 . . . . 25.0 109.024 177.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.6 p -118.42 161.46 35.23 Favored Pre-proline 0 C--N 1.319 -0.748 1 N-CA-C 99.978 -4.082 . . . . 25.0 99.978 162.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -69.95 0.04 6.36 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 116.993 -1.538 . . . . 25.0 115.923 -174.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.2 t -127.29 9.25 6.66 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.336 0.495 . . . . 25.0 112.336 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -82.26 -31.15 30.29 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.094 1.146 . . . . 25.0 114.094 -175.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.423 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 15.0 m95 -119.61 164.95 15.09 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 110.41 -0.218 . . . . 25.0 110.41 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -67.54 120.09 13.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.908 -1.886 . . . . 25.0 105.908 171.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -94.7 103.09 15.0 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 100.849 -3.76 . . . . 25.0 100.849 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.18 135.09 55.04 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.935 -1.03 . . . . 25.0 110.397 -177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -89.59 100.88 13.59 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.515 -1.22 . . . . 25.0 107.921 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.4 mt -130.26 173.85 10.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 -176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.64 157.08 23.58 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.584 -0.734 . . . . 25.0 111.008 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.405 HG21 ' HA ' ' A' ' 139' ' ' ALA . 58.6 p -77.12 167.12 22.31 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 106.703 -1.591 . . . . 25.0 106.703 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.14 -160.62 24.03 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 110.487 -1.045 . . . . 25.0 110.487 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.06 132.57 48.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 119.122 1.461 . . . . 25.0 114.43 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -138.58 161.68 36.47 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.13 -1.804 . . . . 25.0 106.13 177.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.8 p -103.38 149.85 24.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -137.14 100.97 4.41 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 105.521 -2.029 . . . . 25.0 105.521 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.31 114.72 28.8 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.105 0.955 . . . . 25.0 110.065 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -98.88 146.68 25.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.148 -0.933 . . . . 25.0 109.593 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -125.29 110.43 14.0 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 104.605 -2.368 . . . . 25.0 104.605 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -107.36 135.73 48.36 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.74 -0.664 . . . . 25.0 111.007 -172.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.6 t -98.93 16.15 23.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.856 0.836 . . . . 25.0 109.183 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -131.23 135.0 47.0 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.415 -0.587 . . . . 25.0 109.415 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -87.72 -11.98 46.63 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.391 0.515 . . . . 25.0 112.391 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.54 160.72 32.2 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.665 0.617 . . . . 25.0 112.665 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 155.96 39.75 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 116.101 1.889 . . . . 25.0 116.101 -171.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.7 t -102.55 159.24 15.62 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.973 -1.121 . . . . 25.0 107.973 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.3 t -117.9 -14.73 10.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.069 0.396 . . . . 25.0 112.069 172.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.3 t -171.23 153.61 3.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.022 0.439 . . . . 25.0 112.179 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -127.9 139.14 52.78 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 169.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -146.72 152.73 39.29 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.361 -0.977 . . . . 25.0 108.361 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -137.98 135.76 36.3 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.41 -1.7 . . . . 25.0 106.41 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.28 163.36 37.9 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.93 165.77 31.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 113.694 0.998 . . . . 25.0 113.694 -167.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 18.4 p -79.69 162.52 25.16 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 169.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -62.78 159.14 47.03 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.474 -0.784 . . . . 25.0 108.963 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.13 -25.54 31.42 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 116.194 -2.071 . . . . 25.0 113.985 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -113.93 32.03 6.14 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 122.811 0.444 . . . . 25.0 110.736 -175.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.491 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.2 p-90 -71.7 166.62 21.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.958 0.885 . . . . 25.0 112.818 -176.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.87 101.0 10.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.658 -1.155 . . . . 25.0 109.504 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.491 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -91.59 12.95 19.29 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 116.706 2.113 . . . . 25.0 116.706 -168.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.1 t -125.51 12.44 8.07 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.252 -1.018 . . . . 25.0 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.9 mp0 -114.09 157.12 43.02 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.374 -1.285 . . . . 25.0 107.886 -174.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.36 153.16 79.07 Favored 'Trans proline' 0 CA--C 1.533 0.451 0 O-C-N 121.953 0.449 . . . . 25.0 111.59 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 102.56 2.89 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.383 0.611 . . . . 25.0 111.932 -176.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.1 p -89.13 156.54 18.75 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.154 -1.054 . . . . 25.0 108.154 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -65.56 -25.89 67.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.265 0.555 . . . . 25.0 110.85 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.44 60.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.816 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.5 t -78.76 -7.68 58.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.37 0.507 . . . . 25.0 112.37 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 66.1 m-85 -101.63 158.05 16.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.469 1.285 . . . . 25.0 114.469 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -95.72 95.42 8.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 102.655 -3.091 . . . . 25.0 102.655 162.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.1 mt -66.15 -7.58 18.82 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.832 1.419 . . . . 25.0 114.832 -169.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.66 120.25 76.16 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 176.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.52 142.19 43.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.368 -2.621 . . . . 25.0 111.666 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -92.27 -12.31 32.92 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.249 0.462 . . . . 25.0 112.249 -175.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 69.3 m -148.05 64.71 1.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.367 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -88.93 130.97 35.34 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 118.496 -1.282 . . . . 25.0 109.062 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -119.79 99.08 6.42 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 103.689 -2.708 . . . . 25.0 103.689 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -94.02 91.83 7.05 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.6 118.84 37.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 104.424 -2.436 . . . . 25.0 104.424 173.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.35 81.8 0.41 Allowed Glycine 0 CA--C 1.502 -0.758 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.423 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.79 14.81 4.59 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.973 -0.632 . . . . 25.0 113.168 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.86 106.16 5.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.591 0.71 . . . . 25.0 109.691 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.6 123.94 90.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 105.353 -2.092 . . . . 25.0 105.353 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.79 168.87 23.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 N-CA-C 113.765 0.641 . . . . 25.0 113.765 -174.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.82 26.77 4.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.51 -17.05 0.29 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 125.823 1.649 . . . . 25.0 112.188 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.9 mt-30 -128.21 153.13 47.26 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.034 -2.58 . . . . 25.0 104.034 169.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.8 t -142.82 95.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.2 t -94.01 126.64 39.35 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.74 166.99 21.68 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.416 -2.068 . . . . 25.0 105.416 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -130.71 154.39 48.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.581 -2.007 . . . . 25.0 105.581 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.63 160.19 36.24 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.628 -1.249 . . . . 25.0 107.628 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -104.38 116.43 32.12 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.192 0.307 . . . . 25.0 111.346 -176.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.4 mt -77.29 132.4 70.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.121 -1.066 . . . . 25.0 108.121 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -61.14 146.43 97.59 Favored 'Trans proline' 0 C--N 1.354 0.846 0 CA-C-O 121.655 0.606 . . . . 25.0 113.547 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.405 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.85 -26.11 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.197 -0.91 . . . . 25.0 112.802 -168.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.9 p-10 -84.16 9.69 12.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.545 0.688 . . . . 25.0 110.153 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.2 53.39 0.83 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.76 0.791 . . . . 25.0 108.977 172.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -86.04 169.32 13.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.409 -1.33 . . . . 25.0 107.409 175.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.75 -167.72 37.04 Favored Glycine 0 N--CA 1.451 -0.338 0 N-CA-C 115.733 1.053 . . . . 25.0 115.733 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -85.95 107.81 17.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.534 0.683 . . . . 25.0 110.478 -169.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 45.7 p-80 -157.21 171.92 19.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.678 -0.692 . . . . 25.0 110.512 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.9 p -108.03 150.64 10.54 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.125 -1.065 . . . . 25.0 108.125 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.8 mt -132.04 122.7 49.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 104.247 -2.501 . . . . 25.0 104.247 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.6 mp -105.05 127.68 52.99 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.588 -0.733 . . . . 25.0 110.004 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.16 127.59 55.98 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.851 -0.796 . . . . 25.0 108.851 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.63 140.62 46.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 122.075 0.94 . . . . 25.0 112.016 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -117.77 119.4 34.79 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.09 124.18 42.49 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.673 -0.862 . . . . 25.0 108.673 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.9 mm -76.75 141.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.084 -0.71 . . . . 25.0 109.084 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.69 -44.96 22.41 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.192 0.905 . . . . 25.0 110.482 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.14 -21.35 64.93 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -171.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 56.1 p -138.45 169.53 17.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.85 0.833 . . . . 25.0 109.765 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.66 23.2 0.54 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.284 -0.871 . . . . 25.0 112.107 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -94.94 144.12 25.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.36 143.77 16.64 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 104.513 -2.402 . . . . 25.0 104.513 172.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -145.87 134.87 22.62 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.739 0.644 . . . . 25.0 112.739 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.76 113.94 26.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.492 -0.776 . . . . 25.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.02 108.0 20.64 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.04 141.9 31.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.461 -0.79 . . . . 25.0 111.511 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.0 tt -125.37 133.84 68.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.478 -2.045 . . . . 25.0 105.478 167.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -93.7 131.26 39.2 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.1 m -132.59 161.07 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -175.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -117.64 95.02 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 103.67 -2.715 . . . . 25.0 103.67 167.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.57 163.82 14.44 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.027 -0.533 . . . . 25.0 112.29 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.7 p -145.68 163.37 35.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.015 -1.106 . . . . 25.0 108.015 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 CA-C-O 118.085 -0.96 . . . . 25.0 110.821 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 m80 . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 110.294 -0.262 . . . . 25.0 110.294 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 142.78 169.74 12.47 Favored Glycine 0 C--O 1.229 -0.199 0 N-CA-C 103.283 -3.927 . . . . 25.0 103.283 -173.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -146.14 167.87 22.38 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.886 1.843 . . . . 25.0 109.793 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.92 125.11 64.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 107.103 -1.443 . . . . 25.0 107.103 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.93 -42.6 48.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.945 -1.025 . . . . 25.0 109.951 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.3 t -153.59 129.49 5.28 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 105.755 -1.943 . . . . 25.0 105.755 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -64.24 131.95 12.68 Favored 'Cis proline' 0 CA--C 1.533 0.432 0 C-N-CA 128.774 0.739 . . . . 25.0 111.373 -0.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.54 109.96 3.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.016 -0.538 . . . . 25.0 111.477 -173.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -72.0 162.42 29.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.559 -0.534 . . . . 25.0 109.559 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -60.0 -22.28 62.38 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.089 0.471 . . . . 25.0 111.765 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.53 19.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.809 -0.812 . . . . 25.0 108.809 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -64.93 -37.76 88.71 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.659 -0.7 . . . . 25.0 110.411 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -63.06 -32.14 73.44 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.311 -0.243 . . . . 25.0 111.058 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -39.62 92.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.051 0.453 . . . . 25.0 110.325 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.451 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.3 tmtm? -69.84 -34.22 73.35 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.168 0.509 . . . . 25.0 109.975 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -75.16 2.88 9.75 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.374 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.71 10.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.405 1.482 . . . . 25.0 112.778 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.469 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.6 mt -86.85 -21.71 26.23 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.335 -1.357 . . . . 25.0 107.335 173.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.469 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 157.35 32.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.337 -2.097 . . . . 25.0 105.337 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.2 p -135.6 176.21 8.88 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.987 -0.375 . . . . 25.0 109.987 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 72.15 5.29 5.27 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.096 1.517 . . . . 25.0 115.096 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -69.13 -39.7 78.71 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 121.734 -0.604 . . . . 25.0 110.908 173.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.99 -63.76 2.0 Favored Glycine 0 C--O 1.217 -0.908 0 N-CA-C 111.831 -0.508 . . . . 25.0 111.831 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.3 p -87.98 -52.98 4.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.466 1.127 . . . . 25.0 111.953 -178.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 29' ' ' PRO . 1.0 OUTLIER -68.2 -11.61 14.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.324 -1.307 . . . . 25.0 112.708 -171.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.22 -0.76 57.21 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.918 -0.489 . . . . 25.0 111.896 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -117.12 -35.44 4.07 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.679 -0.809 . . . . 25.0 109.845 172.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -127.04 94.8 38.38 Favored Pre-proline 0 CA--C 1.543 0.68 0 N-CA-C 111.797 0.295 . . . . 25.0 111.797 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.451 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 96.5 Cg_endo -71.83 -19.92 26.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 N-CA-C 115.111 1.158 . . . . 25.0 115.111 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.54 9.3 13.92 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 121.804 -0.56 . . . . 25.0 112.219 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.8 m -67.61 -14.67 63.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.7 m -64.11 131.9 29.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.238 0.829 . . . . 25.0 113.238 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -152.94 149.21 27.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.266 -1.012 . . . . 25.0 108.266 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.71 -168.3 17.83 Favored Glycine 0 N--CA 1.452 -0.233 0 N-CA-C 109.503 -1.439 . . . . 25.0 109.503 -178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.92 149.78 49.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.732 0.766 . . . . 25.0 111.213 -177.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.53 156.89 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.217 -1.401 . . . . 25.0 107.217 171.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.52 -0.14 3.4 Favored Glycine 0 C--N 1.318 -0.462 0 CA-C-N 115.099 -0.955 . . . . 25.0 113.373 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -75.93 146.44 79.24 Favored Pre-proline 0 C--N 1.321 -0.653 0 O-C-N 121.678 -0.895 . . . . 25.0 108.669 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.56 -16.97 16.52 Favored 'Cis proline' 0 CA--C 1.542 0.907 0 N-CA-C 115.834 1.436 . . . . 25.0 115.834 -5.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -74.09 -36.91 64.29 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.343 1.238 . . . . 25.0 114.343 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -111.63 32.86 5.11 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.322 -2.103 . . . . 25.0 105.322 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.29 -177.38 47.31 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.375 -1.284 . . . . 25.0 110.67 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -62.85 172.75 4.41 Favored 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 122.812 2.342 . . . . 25.0 113.784 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.08 30.96 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 106.44 -1.689 . . . . 25.0 106.44 173.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 139.47 58.05 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.489 -1.232 . . . . 25.0 108.072 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.89 -2.82 87.05 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 121.487 -0.387 . . . . 25.0 112.614 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 47.2 m170 -125.82 9.79 7.63 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.277 -0.543 . . . . 25.0 110.348 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.0 mt -66.29 -45.27 90.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 O-C-N 122.028 -0.42 . . . . 25.0 111.04 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.12 -23.43 57.89 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.863 -0.523 . . . . 25.0 109.882 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.0 p -82.83 -7.53 59.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.57 35.19 17.33 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.568 0.747 . . . . 25.0 110.499 -173.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 60.63 36.04 19.75 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -177.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -118.71 131.25 56.14 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 122.067 -0.395 . . . . 25.0 110.65 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -61.61 -32.28 72.4 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 113.922 1.082 . . . . 25.0 113.922 -176.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -69.19 -9.98 55.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.821 0.674 . . . . 25.0 112.821 -178.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.731 ' HA ' HD13 ' A' ' 59' ' ' LEU . 11.4 m-85 -121.7 16.37 11.09 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.79 -36.19 67.55 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.172 -0.955 . . . . 25.0 110.605 -177.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 mp0 -70.76 -16.63 62.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.088 0.947 . . . . 25.0 108.906 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.731 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -88.85 -2.36 58.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.095 -0.957 . . . . 25.0 108.902 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -112.1 -31.98 6.71 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -96.07 118.17 32.13 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.731 -0.606 . . . . 25.0 110.55 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.458 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.78 161.05 26.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.64 -0.709 . . . . 25.0 109.598 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.1 p -117.2 162.34 28.45 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 100.572 -3.862 . . . . 25.0 100.572 163.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.28 -4.96 14.75 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 116.756 -1.696 . . . . 25.0 115.972 -174.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -127.88 13.63 6.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.81 0.814 . . . . 25.0 111.022 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -77.81 -29.14 50.58 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.37 -0.831 . . . . 25.0 112.55 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.458 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.0 m95 -127.54 168.16 15.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 110.068 -0.345 . . . . 25.0 110.068 -178.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -67.94 120.94 15.03 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 106.6 -1.63 . . . . 25.0 106.6 171.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -95.8 104.76 16.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 100.358 -3.942 . . . . 25.0 100.358 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.83 134.95 53.14 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 114.857 -1.065 . . . . 25.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.05 99.86 12.79 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.56 -1.2 . . . . 25.0 107.925 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.3 mt -131.89 173.92 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 105.759 -1.941 . . . . 25.0 105.759 -176.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -116.51 168.95 9.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.576 0.703 . . . . 25.0 112.57 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.4 p -77.15 173.07 12.26 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 106.365 -1.717 . . . . 25.0 106.365 173.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.07 -162.23 33.64 Favored Glycine 0 C--O 1.241 0.546 0 C-N-CA 120.388 -0.911 . . . . 25.0 111.027 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.97 131.28 40.81 Favored 'Trans proline' 0 C--N 1.345 0.366 0 CA-C-N 118.869 1.334 . . . . 25.0 114.766 -175.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -138.17 161.39 36.95 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.8 p -104.85 152.03 23.11 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -139.31 101.01 4.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.969 -1.863 . . . . 25.0 105.969 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.91 110.16 22.2 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 122.063 0.935 . . . . 25.0 110.54 -178.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -93.96 147.69 22.87 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.28 -0.873 . . . . 25.0 110.113 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -125.34 110.13 13.62 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.741 -2.318 . . . . 25.0 104.741 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.0 mp -102.93 128.74 49.6 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.481 -0.782 . . . . 25.0 110.865 -171.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.8 t -85.58 3.9 38.59 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.105 0.479 . . . . 25.0 111.764 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.8 143.24 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.596 -0.52 . . . . 25.0 109.596 -177.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -84.13 -2.42 56.76 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.983 0.735 . . . . 25.0 112.983 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.97 158.76 24.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.075 0.769 . . . . 25.0 113.075 -176.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.7 t -75.78 155.97 34.98 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.367 1.247 . . . . 25.0 114.367 -172.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.5 t -103.37 155.98 18.08 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.6 -0.727 . . . . 25.0 109.615 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.4 t -117.79 -16.96 9.94 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 111.741 0.275 . . . . 25.0 111.741 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -171.34 154.31 3.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.069 0.461 . . . . 25.0 112.006 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -127.75 142.14 51.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 104.129 -2.545 . . . . 25.0 104.129 168.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -147.42 154.66 41.12 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.121 0.873 . . . . 25.0 108.93 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -137.91 139.01 39.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.888 -1.523 . . . . 25.0 106.888 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -148.9 164.33 34.82 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.573 0.624 . . . . 25.0 110.167 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.11 166.45 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -167.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 p -81.23 164.25 22.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.76 157.06 51.66 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.22 -0.9 . . . . 25.0 109.716 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -68.83 -20.07 39.94 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.891 -0.94 . . . . 25.0 114.535 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -120.96 32.02 6.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.228 0.455 . . . . 25.0 112.228 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.3 p-90 -74.95 164.86 26.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.694 0.759 . . . . 25.0 111.71 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -86.64 100.99 12.84 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.979 -1.01 . . . . 25.0 110.28 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -81.24 23.28 0.6 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 116.12 1.896 . . . . 25.0 116.12 -172.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.6 t -125.84 2.86 7.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.318 0.58 . . . . 25.0 110.482 175.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -108.69 157.02 37.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.329 -0.85 . . . . 25.0 109.477 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.4 153.21 78.13 Favored 'Trans proline' 0 C--N 1.348 0.539 0 O-C-N 121.943 0.444 . . . . 25.0 111.587 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 104.83 3.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.441 0.638 . . . . 25.0 112.313 -175.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.8 p -95.25 156.8 16.17 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 176.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -67.4 -25.17 65.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.3 0.571 . . . . 25.0 110.635 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.17 -25.13 63.29 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.277 -0.874 . . . . 25.0 111.858 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.4 t -85.05 -5.11 59.36 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.954 0.407 . . . . 25.0 111.807 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -103.11 153.83 19.91 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 114.993 1.479 . . . . 25.0 114.993 -174.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.35 90.02 4.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 102.604 -3.11 . . . . 25.0 102.604 163.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.0 -6.39 12.61 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.934 1.457 . . . . 25.0 114.934 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.2 t -80.13 132.68 59.17 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.165 -0.68 . . . . 25.0 109.165 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.8 149.8 48.72 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 114.94 -2.907 . . . . 25.0 110.82 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -102.63 -9.84 19.76 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.969 0.414 . . . . 25.0 111.425 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 54.5 m -150.36 67.89 0.97 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.451 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -89.02 132.88 34.55 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 118.87 -1.132 . . . . 25.0 108.788 175.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -121.68 99.06 6.25 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 104.166 -2.531 . . . . 25.0 104.166 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -89.65 92.11 8.94 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.134 -1.062 . . . . 25.0 108.134 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -109.17 118.28 36.33 Favored 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 107.428 -1.323 . . . . 25.0 107.428 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.69 80.87 0.42 Allowed Glycine 0 CA--C 1.501 -0.795 0 CA-C-N 115.568 -0.742 . . . . 25.0 112.963 -170.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.6 16.94 6.74 Favored Glycine 0 C--N 1.321 -0.289 0 C-N-CA 120.793 -0.717 . . . . 25.0 114.296 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.15 104.88 3.2 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.2 mt -68.68 122.33 84.37 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.27 170.54 19.34 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 117.748 -1.035 . . . . 25.0 113.694 -175.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.84 29.09 6.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.356 -0.979 . . . . 25.0 108.356 176.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.16 -15.67 0.33 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.693 1.597 . . . . 25.0 112.152 -174.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.424 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.1 mt-30 -128.59 152.47 48.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 103.598 -2.742 . . . . 25.0 103.598 170.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.3 t -141.38 95.11 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 107.013 -1.477 . . . . 25.0 107.013 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -84.92 134.72 34.25 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 105.514 -2.032 . . . . 25.0 105.514 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.47 165.77 26.35 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 105.626 -1.99 . . . . 25.0 105.626 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -135.5 152.22 51.12 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 104.705 -2.331 . . . . 25.0 104.705 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.87 160.24 30.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.38 -1.341 . . . . 25.0 107.38 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -103.44 118.87 37.74 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.111 0.257 . . . . 25.0 110.924 -177.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.0 mt -76.87 132.57 71.11 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.06 146.25 96.25 Favored 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-O 121.818 0.674 . . . . 25.0 113.456 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.75 -25.18 44.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.991 -1.004 . . . . 25.0 112.721 -169.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -84.48 7.98 18.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.682 -0.69 . . . . 25.0 110.119 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.6 mmt-85 -115.64 55.12 0.79 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 108.41 -0.959 . . . . 25.0 108.41 172.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.6 p -86.02 170.99 11.76 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.176 -1.787 . . . . 25.0 106.176 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.09 -169.53 44.15 Favored Glycine 0 C--N 1.32 -0.311 0 N-CA-C 115.64 1.016 . . . . 25.0 115.64 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.9 t -86.06 113.6 22.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.314 0.578 . . . . 25.0 110.86 -169.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.476 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 52.4 p-80 -159.92 171.78 18.79 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.956 -0.566 . . . . 25.0 111.049 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.6 p -105.01 151.16 7.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.348 -1.353 . . . . 25.0 107.348 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -134.63 128.33 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 102.475 -3.157 . . . . 25.0 102.475 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.8 mp -113.12 131.74 55.72 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 116.067 -0.515 . . . . 25.0 109.659 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.73 131.22 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 25.0 109.565 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -127.55 142.91 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 122.064 0.935 . . . . 25.0 112.525 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -115.57 119.66 36.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.84 -1.527 . . . . 25.0 107.104 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.91 121.89 39.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.086 -1.079 . . . . 25.0 108.086 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 13.1 mm -77.66 143.2 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.002 -0.74 . . . . 25.0 109.002 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.63 -42.9 27.56 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.971 0.805 . . . . 25.0 109.792 175.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.01 -23.7 65.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 114.075 1.139 . . . . 25.0 114.075 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 45.4 p -139.02 168.82 18.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.967 0.889 . . . . 25.0 110.374 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.4 18.7 1.09 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.181 -0.918 . . . . 25.0 112.246 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -90.06 146.59 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.71 138.6 10.83 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.797 -1.927 . . . . 25.0 105.797 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -138.79 132.97 31.49 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.126 0.421 . . . . 25.0 112.032 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -93.18 115.03 27.67 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.653 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -97.05 112.63 24.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.204 -0.665 . . . . 25.0 109.204 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.1 139.12 37.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.915 -0.584 . . . . 25.0 112.163 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -126.45 135.24 64.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.327 -2.101 . . . . 25.0 105.327 166.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -93.67 132.67 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.614 -1.254 . . . . 25.0 107.614 176.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -133.23 161.69 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.539 0.57 . . . . 25.0 112.539 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -120.98 95.04 4.54 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.784 -2.302 . . . . 25.0 104.784 170.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.7 tp -93.53 160.0 14.98 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 114.157 1.169 . . . . 25.0 114.157 -170.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.3 p -145.9 173.03 12.5 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.567 -0.531 . . . . 25.0 109.567 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.74 0 N-CA-C 108.609 -0.886 . . . . 25.0 108.609 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 15.8 m170 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 121.304 0.573 . . . . 25.0 110.752 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.65 167.52 35.38 Favored Glycine 0 C--N 1.322 -0.218 1 N-CA-C 102.147 -4.381 . . . . 25.0 102.147 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -146.1 166.49 25.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 120.071 1.936 . . . . 25.0 109.915 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.89 124.03 63.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.814 -1.18 . . . . 25.0 107.814 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -40.53 56.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.767 -1.106 . . . . 25.0 110.384 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -153.28 128.21 4.81 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -65.55 134.59 21.38 Favored 'Cis proline' 0 C--N 1.347 0.482 0 CA-C-N 118.814 0.612 . . . . 25.0 110.88 -0.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.09 4.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.105 -0.498 . . . . 25.0 111.079 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.7 p -72.13 164.41 26.23 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -59.55 -22.46 61.73 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.183 0.516 . . . . 25.0 111.777 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.71 -52.93 25.55 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.05 -0.722 . . . . 25.0 109.05 175.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -67.37 -35.07 78.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.019 -0.537 . . . . 25.0 110.928 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -63.97 -32.15 73.58 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.061 -0.4 . . . . 25.0 110.739 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -40.48 96.44 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.418 0.628 . . . . 25.0 109.496 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.58 -34.31 76.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.022 -0.535 . . . . 25.0 110.362 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.5 mt -79.78 5.3 13.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.575 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.49 23.02 10.28 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.029 1.331 . . . . 25.0 113.233 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.474 ' C ' HD22 ' A' ' 19' ' ' ASN . 96.0 mt -88.18 -21.03 24.8 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.741 -1.207 . . . . 25.0 107.741 174.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.474 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.62 159.53 29.07 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 105.148 -2.168 . . . . 25.0 105.148 176.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.4 p -135.16 175.64 9.4 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 122.215 0.206 . . . . 25.0 110.517 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 71.46 5.06 5.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.75 1.759 . . . . 25.0 115.75 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -68.26 -38.95 82.28 Favored 'General case' 0 CA--C 1.501 -0.92 0 O-C-N 121.53 -0.731 . . . . 25.0 111.392 175.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.95 -64.21 1.57 Allowed Glycine 0 C--O 1.218 -0.869 0 O-C-N 123.575 0.547 . . . . 25.0 112.087 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -87.98 -53.29 4.81 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.581 1.181 . . . . 25.0 111.599 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.13 -7.97 9.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.017 -172.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.83 2.74 53.11 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.825 -0.547 . . . . 25.0 111.527 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -119.72 -33.98 3.88 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.949 -0.7 . . . . 25.0 109.98 172.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -126.98 103.9 23.34 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 110.102 -0.333 . . . . 25.0 110.102 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.98 -21.11 21.2 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.034 -1.511 . . . . 25.0 114.678 -175.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.99 12.89 6.72 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.0 m -66.79 -13.77 61.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.829 0.307 . . . . 25.0 111.829 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 27.8 m -65.72 135.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 113.654 0.983 . . . . 25.0 113.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -153.06 151.55 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -157.92 -172.08 24.65 Favored Glycine 0 C--N 1.328 0.115 0 N-CA-C 110.575 -1.01 . . . . 25.0 110.575 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 tp -127.62 148.29 50.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.011 0.906 . . . . 25.0 112.011 -177.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.63 156.97 33.69 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.008 -1.108 . . . . 25.0 108.008 172.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 134.85 2.36 3.14 Favored Glycine 0 C--O 1.224 -0.489 0 CA-C-N 114.832 -1.076 . . . . 25.0 113.285 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -75.78 141.44 72.06 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 121.536 -0.979 . . . . 25.0 109.757 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -92.07 -18.37 12.98 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 N-CA-C 115.899 1.461 . . . . 25.0 115.899 -5.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -73.13 -35.19 66.47 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.043 1.497 . . . . 25.0 115.043 -168.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.93 38.23 3.72 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.16 -2.163 . . . . 25.0 105.16 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -111.9 -171.77 18.93 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 114.345 -1.298 . . . . 25.0 110.444 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.74 167.27 10.43 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.19 1.926 . . . . 25.0 114.739 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.02 159.97 31.09 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.727 -1.583 . . . . 25.0 106.727 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.11 139.24 57.62 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.287 -1.324 . . . . 25.0 108.914 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.49 -2.91 84.27 Favored Glycine 0 C--O 1.225 -0.415 0 CA-C-N 116.038 -0.528 . . . . 25.0 112.806 -175.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -124.5 11.73 8.63 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.473 -0.936 . . . . 25.0 108.473 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 59.5 mt -65.21 -54.35 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 112.61 0.596 . . . . 25.0 112.61 -171.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.26 -20.17 60.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.874 0.845 . . . . 25.0 108.798 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 t -74.56 -16.26 60.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.962 . . . . 25.0 111.792 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 55.26 26.24 8.3 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.38 0.672 . . . . 25.0 109.94 -172.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.57 35.78 22.66 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.781 1.232 . . . . 25.0 114.106 -176.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -122.3 133.97 54.67 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.183 0.593 . . . . 25.0 111.051 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -59.87 -31.96 70.26 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 115.092 1.515 . . . . 25.0 115.092 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.6 OUTLIER -70.09 -10.25 58.13 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.191 0.441 . . . . 25.0 112.191 -179.249 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.676 ' HA ' HD13 ' A' ' 59' ' ' LEU . 8.4 m-85 -123.63 16.23 9.54 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -71.12 -41.59 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.058 -1.026 . . . . 25.0 111.613 -174.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -73.43 -11.09 60.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.717 0.77 . . . . 25.0 109.722 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.676 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.9 mp -84.26 -6.61 59.42 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -114.83 -34.96 4.95 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.638 0.607 . . . . 25.0 112.638 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -89.42 113.5 24.85 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.651 -0.656 . . . . 25.0 111.094 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.0 pm0 -121.92 160.99 23.64 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.661 -0.7 . . . . 25.0 109.376 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -119.97 163.88 25.49 Favored Pre-proline 0 C--N 1.317 -0.825 1 N-CA-C 99.95 -4.093 . . . . 25.0 99.95 162.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.92 -5.78 17.11 Favored 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 116.196 -2.069 . . . . 25.0 115.669 -175.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -121.41 9.78 10.39 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.712 0.768 . . . . 25.0 111.115 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -77.78 -28.72 50.61 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.39 -0.819 . . . . 25.0 113.013 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 13.0 m95 -127.21 167.61 15.84 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.87 0.367 . . . . 25.0 111.717 -177.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -67.75 119.12 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 106.124 -1.806 . . . . 25.0 106.124 167.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -92.54 104.25 16.57 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 100.934 -3.728 . . . . 25.0 100.934 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.75 135.34 54.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.589 -1.187 . . . . 25.0 110.165 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -93.33 102.2 14.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.733 -1.121 . . . . 25.0 108.187 -177.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.6 mt -130.01 173.99 10.2 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.001 -1.111 . . . . 25.0 108.001 -176.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.46 156.89 26.05 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.55 -0.75 . . . . 25.0 111.562 -175.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.472 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.1 p -77.17 166.26 23.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.95 -1.5 . . . . 25.0 106.95 173.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.03 -164.5 21.57 Favored Glycine 0 C--O 1.239 0.454 0 N-CA-C 110.677 -0.969 . . . . 25.0 110.677 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.38 134.2 59.83 Favored 'Trans proline' 0 C--N 1.346 0.417 0 CA-C-N 118.972 1.386 . . . . 25.0 114.278 -177.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -140.84 161.66 37.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.309 -1.738 . . . . 25.0 106.309 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.2 p -105.4 152.12 23.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.837 -1.172 . . . . 25.0 107.837 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -139.45 101.02 4.13 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 105.967 -1.864 . . . . 25.0 105.967 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.39 108.77 20.15 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.79 0.805 . . . . 25.0 110.341 -178.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -97.75 148.67 23.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.602 -0.726 . . . . 25.0 110.094 -178.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -127.25 116.33 20.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 104.205 -2.517 . . . . 25.0 104.205 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -112.26 119.22 37.59 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.455 -0.793 . . . . 25.0 110.573 -173.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.01 18.58 3.48 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.507 0.67 . . . . 25.0 110.999 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.11 138.23 36.86 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.509 -0.552 . . . . 25.0 109.509 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -86.07 -7.15 58.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.488 0.922 . . . . 25.0 113.488 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.57 154.49 32.48 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.457 0.54 . . . . 25.0 112.457 -176.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.9 t -72.7 155.94 39.47 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -173.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.418 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.7 t -97.97 158.35 15.59 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 173.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.7 -14.98 10.17 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.041 0.213 . . . . 25.0 111.182 171.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -173.28 153.3 2.4 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.866 0.365 . . . . 25.0 111.826 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.07 139.08 54.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.225 -2.509 . . . . 25.0 104.225 166.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -143.08 148.18 36.24 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -137.92 132.36 32.29 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -149.52 164.01 36.25 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.65 0.659 . . . . 25.0 110.517 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.29 164.12 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -167.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.6 p -77.89 163.5 25.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.18 155.15 47.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.221 -0.899 . . . . 25.0 109.703 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -68.87 -23.01 35.56 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 117.404 -1.264 . . . . 25.0 113.633 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -113.09 32.07 5.99 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.607 0.363 . . . . 25.0 111.476 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 3.8 p-90 -82.28 163.06 22.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.674 0.75 . . . . 25.0 111.044 -177.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -93.28 100.98 13.23 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.096 -0.956 . . . . 25.0 110.574 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.484 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -74.01 19.92 0.11 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.817 1.784 . . . . 25.0 115.817 -175.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -112.52 -6.28 13.97 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 174.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -100.25 157.09 34.45 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.449 -0.796 . . . . 25.0 109.286 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 159.08 54.03 Favored 'Trans proline' 0 C--N 1.346 0.426 0 O-C-N 121.962 0.453 . . . . 25.0 112.241 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.98 99.95 1.89 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.076 0.465 . . . . 25.0 111.115 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.6 p -99.14 154.65 17.97 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.604 -0.887 . . . . 25.0 108.604 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -65.59 -25.62 67.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.255 0.55 . . . . 25.0 110.635 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.18 -25.19 63.31 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 25.0 111.973 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 30.8 t -89.6 -3.1 58.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.819 0.343 . . . . 25.0 111.597 -178.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -101.09 152.38 20.68 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.903 1.075 . . . . 25.0 113.903 -175.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -100.16 95.23 6.68 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 103.108 -2.923 . . . . 25.0 103.108 164.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -67.65 -6.4 20.32 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.195 1.183 . . . . 25.0 114.195 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.16 125.36 85.22 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 109.12 -0.696 . . . . 25.0 109.12 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -72.86 148.57 46.14 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 115.14 -2.773 . . . . 25.0 111.554 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -100.64 -14.77 18.0 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.5 m -147.35 64.42 1.15 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.568 -0.287 . . . . 25.0 111.101 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -89.08 138.59 31.28 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.457 -1.297 . . . . 25.0 108.825 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.59 99.54 6.05 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 103.552 -2.759 . . . . 25.0 103.552 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -92.09 91.87 8.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.692 -1.225 . . . . 25.0 107.692 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -110.25 118.03 35.26 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.67 80.46 0.46 Allowed Glycine 0 CA--C 1.502 -0.744 0 CA-C-N 115.459 -0.791 . . . . 25.0 113.791 -169.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.34 18.9 6.02 Favored Glycine 0 C--N 1.321 -0.263 0 C-N-CA 120.941 -0.647 . . . . 25.0 113.443 178.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.86 106.89 6.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.614 0.721 . . . . 25.0 109.427 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.1 mt -70.73 122.7 87.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 105.834 -1.913 . . . . 25.0 105.834 176.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.5 169.24 21.39 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 118.125 -0.783 . . . . 25.0 113.94 -174.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.0 22.54 6.46 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.852 -0.613 . . . . 25.0 109.542 176.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.55 -17.46 0.28 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 125.716 1.607 . . . . 25.0 112.739 -176.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -128.96 150.06 50.55 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 103.172 -2.899 . . . . 25.0 103.172 168.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.9 t -140.33 94.99 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 38.1 m -89.64 121.5 31.88 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 174.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -132.33 166.95 20.76 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.63 -1.248 . . . . 25.0 107.63 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -132.83 155.73 48.45 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.432 -1.692 . . . . 25.0 106.432 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.48 160.53 23.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 47.7 m-20 -103.94 119.69 39.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.466 0.174 . . . . 25.0 110.57 -177.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.1 mt -76.69 131.06 74.69 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 107.117 -1.438 . . . . 25.0 107.117 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.65 145.92 91.88 Favored 'Trans proline' 0 C--N 1.352 0.751 0 CA-C-O 121.668 0.612 . . . . 25.0 113.384 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.83 -26.48 40.45 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.316 -0.856 . . . . 25.0 112.625 -169.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -82.38 7.11 14.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.6 -0.727 . . . . 25.0 110.275 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -118.59 51.82 1.07 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.268 -1.012 . . . . 25.0 108.268 172.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 9.3 p -85.89 170.99 11.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 106.086 -1.82 . . . . 25.0 106.086 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.01 -171.34 37.2 Favored Glycine 0 N--CA 1.452 -0.259 0 N-CA-C 115.444 0.937 . . . . 25.0 115.444 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.2 t -86.05 109.68 18.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.391 0.615 . . . . 25.0 110.512 -169.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.443 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.3 p-80 -158.26 171.06 20.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.974 -0.557 . . . . 25.0 111.941 -175.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.6 p -104.2 150.58 7.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.1 mt -133.25 121.92 43.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.6 132.91 52.06 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.608 -0.724 . . . . 25.0 109.78 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.25 135.23 53.27 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.193 -0.669 . . . . 25.0 109.193 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.98 144.6 37.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.922 0.868 . . . . 25.0 112.531 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.418 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 13.3 t90 -113.28 112.37 23.6 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.121 -1.807 . . . . 25.0 106.121 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -92.62 125.23 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.0 mm -81.46 141.53 15.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 109.578 -0.527 . . . . 25.0 109.578 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.46 -43.05 24.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.868 0.758 . . . . 25.0 110.409 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -23.92 64.69 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.611 0.967 . . . . 25.0 113.611 -172.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.4 p -138.86 169.99 16.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.912 0.863 . . . . 25.0 109.91 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.05 20.32 0.81 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.223 -0.899 . . . . 25.0 112.189 178.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -90.01 145.9 24.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.592 -0.693 . . . . 25.0 112.731 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.66 136.81 7.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.343 -1.725 . . . . 25.0 106.343 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -137.87 130.33 29.39 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.482 0.549 . . . . 25.0 112.482 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.07 117.59 28.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.65 -0.704 . . . . 25.0 110.605 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -97.13 115.91 28.39 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.801 -1.185 . . . . 25.0 107.801 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.95 142.97 27.59 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.8 136.7 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 104.505 -2.405 . . . . 25.0 104.505 166.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -99.47 129.83 45.68 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.0 m -133.5 162.19 40.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -116.03 95.05 4.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.912 -2.625 . . . . 25.0 103.912 166.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.77 163.09 14.59 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.104 -0.498 . . . . 25.0 112.164 -172.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.6 p -145.98 162.68 37.29 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.847 -0.797 . . . . 25.0 108.847 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.751 0 CA-C-O 118.005 -0.998 . . . . 25.0 111.05 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 m170 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.258 0.552 . . . . 25.0 110.967 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.54 169.98 40.01 Favored Glycine 0 CA--C 1.509 -0.333 1 N-CA-C 102.839 -4.104 . . . . 25.0 102.839 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -145.13 167.28 23.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.891 1.845 . . . . 25.0 109.3 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.75 124.67 64.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.477 -0.935 . . . . 25.0 108.477 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -75.2 -43.5 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.661 -1.154 . . . . 25.0 109.96 -175.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.5 t -152.74 129.27 5.43 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 105.798 -1.927 . . . . 25.0 105.798 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -64.77 132.87 15.45 Favored 'Cis proline' 0 C--N 1.346 0.4 0 CA-C-N 118.791 0.604 . . . . 25.0 110.895 -0.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 109.67 2.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.039 -0.528 . . . . 25.0 111.953 -172.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 t -72.01 157.71 37.32 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -55.25 -25.25 32.46 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.562 0.745 . . . . 25.0 111.828 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.16 -53.52 36.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.659 0.742 . . . . 25.0 109.431 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -67.75 -35.04 78.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.714 -0.675 . . . . 25.0 110.626 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -63.56 -32.35 73.79 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 122.076 -0.39 . . . . 25.0 110.344 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -39.06 92.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 25.0 110.031 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.73 -35.81 79.43 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.058 -0.519 . . . . 25.0 109.821 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.7 mt -77.91 3.54 14.27 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.179 -0.464 . . . . 25.0 111.623 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 57.92 21.98 8.24 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.242 1.417 . . . . 25.0 113.245 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.472 ' C ' HD22 ' A' ' 19' ' ' ASN . 95.6 mt -84.05 -21.37 31.6 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 172.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.472 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.78 158.59 31.41 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.812 -2.292 . . . . 25.0 104.812 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.6 p -136.6 176.02 9.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.918 -0.401 . . . . 25.0 109.918 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 71.97 5.21 5.28 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.516 1.672 . . . . 25.0 115.516 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 78.6 m -68.54 -36.7 79.17 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 121.585 -0.697 . . . . 25.0 111.154 174.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -62.96 1.45 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.681 0.613 . . . . 25.0 112.378 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.3 t -87.97 -53.74 4.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 122.564 1.173 . . . . 25.0 111.868 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.2 t -67.36 -12.37 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.41 -1.268 . . . . 25.0 113.116 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.4 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 14.0 pt20 -87.02 -2.26 58.5 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 121.808 -0.557 . . . . 25.0 111.75 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -117.26 -34.53 4.31 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 119.744 -0.782 . . . . 25.0 110.424 172.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -127.04 98.52 30.21 Favored Pre-proline 0 C--O 1.24 0.597 0 N-CA-C 110.414 -0.217 . . . . 25.0 110.414 170.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.83 -20.68 22.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 116.976 -1.549 . . . . 25.0 114.734 -174.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -82.88 8.83 11.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.845 -0.534 . . . . 25.0 112.384 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m -67.68 -14.65 63.12 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.553 0.575 . . . . 25.0 112.553 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 m -64.16 133.05 30.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 121.703 0.763 . . . . 25.0 112.56 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -153.0 156.06 38.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 105.922 -1.881 . . . . 25.0 105.922 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.17 -169.04 23.89 Favored Glycine 0 N--CA 1.453 -0.167 0 N-CA-C 108.98 -1.648 . . . . 25.0 108.98 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -128.2 148.65 50.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.148 0.974 . . . . 25.0 111.474 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.82 157.05 31.44 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 107.473 -1.306 . . . . 25.0 107.473 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -3.47 2.19 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.751 -1.113 . . . . 25.0 112.484 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -75.89 145.5 77.88 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 108.397 -0.964 . . . . 25.0 108.397 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.75 -19.16 12.07 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 N-CA-C 116.255 1.598 . . . . 25.0 116.255 -4.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -76.61 -35.26 58.18 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.724 1.379 . . . . 25.0 114.724 -169.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.0 30.35 7.11 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.58 -176.22 43.01 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.349 -1.296 . . . . 25.0 110.978 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -62.24 171.15 5.54 Favored 'Trans proline' 0 C--O 1.241 0.626 0 C-N-CA 122.796 2.331 . . . . 25.0 113.934 178.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 159.97 30.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 106.859 -1.534 . . . . 25.0 106.859 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.77 138.17 58.13 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 107.192 -1.41 . . . . 25.0 107.192 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.39 85.67 Favored Glycine 0 C--O 1.229 -0.21 0 C-N-CA 121.468 -0.396 . . . . 25.0 112.962 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -124.92 10.9 8.29 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.742 -0.466 . . . . 25.0 109.742 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 63.3 mt -64.95 -49.15 81.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 122.217 -0.302 . . . . 25.0 111.486 -173.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.24 -21.22 56.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.073 0.463 . . . . 25.0 109.898 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.7 p -83.46 -8.65 59.33 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.569 0.581 . . . . 25.0 112.569 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.63 32.6 12.09 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.556 0.742 . . . . 25.0 110.176 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.34 38.28 25.89 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.727 1.38 . . . . 25.0 114.727 -176.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.54 137.02 54.61 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.023 0.529 . . . . 25.0 110.942 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.41 -35.78 80.3 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 115.135 1.532 . . . . 25.0 115.135 -174.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -70.95 -7.18 44.16 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.529 0.566 . . . . 25.0 112.529 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.5 m-85 -121.47 11.96 10.74 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -72.55 -35.25 67.97 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.891 -1.131 . . . . 25.0 110.218 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.9 mp0 -70.83 -16.05 62.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.889 0.852 . . . . 25.0 109.576 174.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.82 -3.8 58.91 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.789 -0.819 . . . . 25.0 108.789 -177.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -115.1 -32.13 5.81 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.293 0.479 . . . . 25.0 112.293 173.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -91.64 118.08 30.31 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 121.496 -0.752 . . . . 25.0 109.854 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.451 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.9 pm0 -124.06 161.0 26.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.921 -0.581 . . . . 25.0 110.13 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -120.0 162.71 31.97 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 100.25 -3.981 . . . . 25.0 100.25 163.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.06 -7.17 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.775 -1.683 . . . . 25.0 115.786 -175.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -125.18 10.73 8.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.225 0.536 . . . . 25.0 112.018 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -77.32 -28.47 53.19 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.723 -0.61 . . . . 25.0 112.551 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 12.3 m95 -125.11 165.85 17.47 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 120.656 0.265 . . . . 25.0 110.814 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -68.83 120.97 15.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.97 -1.863 . . . . 25.0 105.97 170.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -94.48 103.87 15.83 Favored 'General case' 0 CA--C 1.499 -1.007 1 N-CA-C 99.997 -4.075 . . . . 25.0 99.997 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -66.19 134.58 53.02 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.024 -0.989 . . . . 25.0 110.512 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.83 99.42 12.29 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.715 -1.217 . . . . 25.0 107.715 -178.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.2 mt -130.9 173.94 10.47 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.275 -1.75 . . . . 25.0 106.275 -176.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -113.4 163.73 14.5 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.786 1.032 . . . . 25.0 113.786 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.487 HG22 HD23 ' A' ' 168' ' ' LEU . 77.9 p -77.05 170.81 15.86 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.745 -1.57 . . . . 25.0 106.953 175.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.09 -161.72 29.32 Favored Glycine 0 C--O 1.241 0.581 0 N-CA-C 111.144 -0.782 . . . . 25.0 111.144 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.68 131.34 41.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 118.935 1.368 . . . . 25.0 114.132 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -138.01 160.48 39.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.342 -1.725 . . . . 25.0 106.342 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.3 p -99.39 150.35 22.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.527 -1.286 . . . . 25.0 107.527 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -137.61 100.98 4.35 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 105.54 -2.022 . . . . 25.0 105.54 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.68 112.57 25.33 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.367 -0.833 . . . . 25.0 109.988 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.3 m95 -101.7 151.65 21.78 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 25.0 110.051 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -128.61 114.33 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 104.89 -2.263 . . . . 25.0 104.89 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -116.8 117.98 31.26 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.8 0.84 . . . . 25.0 112.085 -173.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.72 -32.71 69.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.454 0.645 . . . . 25.0 109.828 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.96 106.08 17.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 25.0 110.704 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -70.09 -0.12 7.11 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 115.161 1.541 . . . . 25.0 115.161 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.34 158.32 36.55 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.607 0.241 . . . . 25.0 111.613 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.2 t -67.79 156.09 37.82 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 116.053 1.872 . . . . 25.0 116.053 -170.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.437 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.5 t -99.1 161.05 13.84 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 114.856 -1.066 . . . . 25.0 108.241 172.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 t -117.97 -15.48 9.95 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.114 0.259 . . . . 25.0 111.081 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 t -172.81 155.39 3.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.965 0.412 . . . . 25.0 111.793 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 57.6 m95 -126.67 137.44 53.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 105.137 -2.171 . . . . 25.0 105.137 166.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -139.87 146.15 38.94 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.447 -0.945 . . . . 25.0 108.447 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -137.47 133.7 34.94 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.543 -1.651 . . . . 25.0 106.543 -176.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.99 161.49 42.23 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.557 0.617 . . . . 25.0 110.562 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.4 163.13 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 114.145 1.165 . . . . 25.0 114.145 -168.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.1 p -77.71 159.85 28.83 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.216 -1.031 . . . . 25.0 108.216 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -62.74 157.66 57.29 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.909 -1.042 . . . . 25.0 109.575 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -69.59 -18.24 37.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 N-CA-C 114.861 1.062 . . . . 25.0 114.861 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -118.73 31.85 6.44 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.615 0.366 . . . . 25.0 111.985 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -76.72 163.17 27.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.723 0.773 . . . . 25.0 111.5 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -85.95 101.31 12.78 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.899 -1.046 . . . . 25.0 110.297 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.82 21.67 0.66 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 116.059 1.874 . . . . 25.0 116.059 -173.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.0 t -125.36 0.42 7.69 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.475 0.655 . . . . 25.0 109.669 173.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -103.61 158.81 31.08 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.478 -0.934 . . . . 25.0 108.478 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.62 156.01 67.69 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 121.863 0.401 . . . . 25.0 112.66 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.76 100.87 1.58 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.964 0.412 . . . . 25.0 111.817 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 57.8 p -94.14 152.66 18.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -66.21 -25.17 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.342 0.592 . . . . 25.0 110.804 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.76 -24.61 63.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.348 -0.842 . . . . 25.0 112.093 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.9 t -83.35 -5.24 59.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.709 0.29 . . . . 25.0 111.777 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -102.94 154.02 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.344 1.238 . . . . 25.0 114.344 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -95.33 96.46 9.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 103.167 -2.901 . . . . 25.0 103.167 164.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.1 mt -69.01 -6.67 29.38 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -171.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.46 123.0 83.15 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 108.57 -0.9 . . . . 25.0 108.57 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 139.54 35.07 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 115.059 -2.827 . . . . 25.0 112.148 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -92.2 -12.51 32.56 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -176.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.3 m -147.58 66.88 1.12 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.317 -0.401 . . . . 25.0 110.071 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.01 135.05 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 118.727 -1.189 . . . . 25.0 108.978 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -125.18 99.39 6.07 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.895 -2.631 . . . . 25.0 103.895 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -91.16 91.91 8.44 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 106.694 -1.595 . . . . 25.0 106.694 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -111.76 116.99 31.62 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.114 0.959 . . . . 25.0 108.568 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.73 81.58 0.43 Allowed Glycine 0 CA--C 1.501 -0.818 0 CA-C-N 115.004 -0.998 . . . . 25.0 112.312 -172.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.14 15.04 4.81 Favored Glycine 0 C--O 1.228 -0.276 0 C-N-CA 120.867 -0.682 . . . . 25.0 114.086 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.01 104.06 5.44 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.266 -1.013 . . . . 25.0 108.266 176.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.4 mt -78.74 122.06 84.29 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 107.62 -1.252 . . . . 25.0 107.62 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.0 160.84 42.32 Favored 'Trans proline' 0 C--N 1.347 0.451 0 CA-C-O 121.505 0.544 . . . . 25.0 113.478 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.98 31.95 3.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.78 -4.58 1.66 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 113.618 -1.628 . . . . 25.0 111.435 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.06 152.33 48.71 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.438 -2.43 . . . . 25.0 104.438 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.5 t -141.39 95.09 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.221 -1.77 . . . . 25.0 106.221 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.8 t -85.43 140.98 30.29 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 104.69 -2.337 . . . . 25.0 104.69 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -156.98 166.91 32.02 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.81 -1.541 . . . . 25.0 108.705 -176.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -134.11 157.57 45.82 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.17 160.49 30.2 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -105.61 115.55 30.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.068 0.23 . . . . 25.0 111.034 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.2 mt -77.38 132.62 69.24 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 108.058 -1.09 . . . . 25.0 108.058 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.69 146.5 96.69 Favored 'Trans proline' 0 C--N 1.353 0.791 0 N-CA-C 113.766 0.641 . . . . 25.0 113.766 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -82.2 -25.78 33.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.164 -0.925 . . . . 25.0 112.768 -170.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -83.83 9.83 11.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.684 0.754 . . . . 25.0 110.115 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.2 mmt-85 -116.31 58.08 0.76 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.221 -1.029 . . . . 25.0 108.221 172.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.2 p -86.0 170.85 11.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 107.551 -1.278 . . . . 25.0 107.551 175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 81.89 -163.25 43.59 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.851 1.101 . . . . 25.0 115.851 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.1 t -85.71 107.45 17.59 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.288 0.566 . . . . 25.0 110.693 -168.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.441 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.1 p-80 -156.29 169.71 23.93 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.018 -0.537 . . . . 25.0 111.32 -177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -107.74 151.27 9.84 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.42 120.8 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.14 -2.17 . . . . 25.0 105.14 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -105.18 138.59 41.15 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.513 -0.767 . . . . 25.0 109.955 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -131.84 140.29 49.09 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.166 -0.679 . . . . 25.0 109.166 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -128.59 140.37 49.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.879 0.847 . . . . 25.0 112.358 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.437 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 16.6 t90 -103.42 113.12 26.37 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.395 -1.705 . . . . 25.0 106.395 173.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -94.48 119.95 33.97 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.4 mm -76.92 142.05 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 O-C-N 122.162 -0.336 . . . . 25.0 110.157 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.72 -44.34 20.96 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.551 0.691 . . . . 25.0 110.177 174.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.07 -24.63 65.08 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.778 1.399 . . . . 25.0 114.778 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.6 p -139.26 170.8 15.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 122.142 0.972 . . . . 25.0 110.648 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 18.79 1.25 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.883 -1.053 . . . . 25.0 112.386 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -89.94 148.87 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.727 -0.608 . . . . 25.0 112.172 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.29 143.0 10.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.619 -1.993 . . . . 25.0 105.619 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -146.83 133.8 20.26 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.192 0.441 . . . . 25.0 112.192 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -92.41 115.87 28.47 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.838 -0.619 . . . . 25.0 111.481 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -97.0 122.77 40.36 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.232 -1.025 . . . . 25.0 108.232 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -98.13 143.61 28.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.291 -0.413 . . . . 25.0 111.771 -177.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -125.72 136.49 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 106.144 -1.799 . . . . 25.0 106.144 167.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -97.06 130.58 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.6 -1.259 . . . . 25.0 107.6 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.74 162.66 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.904 0.705 . . . . 25.0 112.904 -174.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.79 95.07 4.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 104.964 -2.235 . . . . 25.0 104.964 168.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.487 HD23 HG22 ' A' ' 74' ' ' THR . 2.1 tp -92.31 158.83 15.89 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.259 1.207 . . . . 25.0 114.259 -169.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.3 p -145.9 165.35 29.2 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.622 -0.51 . . . . 25.0 109.622 176.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.76 0 CA-C-O 118.745 -0.645 . . . . 25.0 110.29 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.3 m80 . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 121.739 0.78 . . . . 25.0 110.429 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.98 167.24 31.83 Favored Glycine 0 C--N 1.318 -0.449 1 N-CA-C 100.05 -5.22 . . . . 25.0 100.05 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -144.25 158.61 43.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 120.484 2.142 . . . . 25.0 110.732 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.52 118.94 36.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 106.428 -1.693 . . . . 25.0 106.428 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -75.91 -41.25 52.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.166 -1.379 . . . . 25.0 109.608 -174.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 t -153.97 129.01 4.93 Favored Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 105.745 -1.946 . . . . 25.0 105.745 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HB2' HD13 ' A' ' 164' ' ' ILE . 65.3 Cg_endo -64.37 131.54 12.0 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.991 0.83 . . . . 25.0 111.316 -0.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 114.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.975 -0.557 . . . . 25.0 112.396 -172.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.0 t -71.98 158.0 36.8 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -55.78 -24.31 34.94 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.264 0.626 . . . . 25.0 111.822 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.79 -54.12 36.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.82 0.819 . . . . 25.0 109.288 175.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -69.03 -34.49 75.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.398 -0.819 . . . . 25.0 110.741 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.44 -33.35 75.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.98 -0.45 . . . . 25.0 110.517 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -39.9 95.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.243 0.545 . . . . 25.0 109.873 177.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -66.32 -36.5 83.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.222 0.534 . . . . 25.0 110.061 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.4 mt -77.27 4.87 9.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.41 176.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.53 24.11 11.55 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.309 1.444 . . . . 25.0 112.647 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.7 mt -88.6 -21.38 24.05 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.841 -1.17 . . . . 25.0 107.841 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.455 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 159.21 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 106.613 -1.625 . . . . 25.0 106.613 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.2 p -132.86 175.48 9.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 122.597 0.359 . . . . 25.0 110.221 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 68.44 5.26 4.68 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.813 1.782 . . . . 25.0 115.813 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.7 m -68.16 -41.08 82.07 Favored 'General case' 0 CA--C 1.501 -0.91 0 O-C-N 121.299 -0.876 . . . . 25.0 111.017 173.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.67 -63.84 1.87 Allowed Glycine 0 C--O 1.218 -0.872 0 O-C-N 123.599 0.562 . . . . 25.0 111.93 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.5 t -87.94 -51.82 5.61 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 122.291 1.043 . . . . 25.0 112.043 -177.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.7 OUTLIER -66.97 -13.25 16.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 114.867 -1.06 . . . . 25.0 113.141 -172.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.86 -4.1 58.41 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.735 -0.603 . . . . 25.0 111.514 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -115.01 -34.03 5.21 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.419 -0.513 . . . . 25.0 110.322 174.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -126.95 95.57 36.73 Favored Pre-proline 0 C--O 1.243 0.754 0 CA-C-O 120.664 0.269 . . . . 25.0 110.412 171.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' VAL . 95.7 Cg_endo -72.51 -19.44 24.84 Favored 'Trans proline' 0 C--N 1.346 0.413 0 N-CA-C 115.097 1.153 . . . . 25.0 115.097 -174.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -91.34 14.14 15.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -176.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -62.89 -18.7 63.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.15 -0.477 . . . . 25.0 112.233 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.7 m -64.08 116.55 3.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 115.191 1.552 . . . . 25.0 115.191 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -153.09 157.44 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.15 -169.24 22.25 Favored Glycine 0 C--O 1.229 -0.168 0 N-CA-C 108.054 -2.018 . . . . 25.0 108.054 -177.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 tp -112.3 147.43 36.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.493 1.147 . . . . 25.0 112.301 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.76 156.97 31.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.676 -1.231 . . . . 25.0 107.676 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.92 -1.72 2.88 Favored Glycine 0 C--O 1.224 -0.501 0 CA-C-N 114.706 -1.134 . . . . 25.0 112.351 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -75.91 144.82 76.76 Favored Pre-proline 0 C--N 1.321 -0.649 0 O-C-N 121.664 -0.904 . . . . 25.0 110.073 -176.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -91.39 -18.07 14.67 Favored 'Cis proline' 0 CA--C 1.542 0.9 0 N-CA-C 115.585 1.34 . . . . 25.0 115.585 -6.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.46 -36.3 60.7 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.124 1.528 . . . . 25.0 115.124 -168.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.61 40.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.35 -167.58 16.69 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.219 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -59.79 168.27 5.84 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 123.1 2.533 . . . . 25.0 114.052 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.03 31.02 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.872 -1.529 . . . . 25.0 106.872 173.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -57.93 140.81 51.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.784 -1.098 . . . . 25.0 108.443 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.94 -4.05 81.68 Favored Glycine 0 C--O 1.225 -0.41 0 CA-C-N 116.012 -0.54 . . . . 25.0 113.091 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -124.25 10.33 8.66 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.456 -0.942 . . . . 25.0 108.456 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.6 mt -68.45 -51.27 48.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 122.311 -0.243 . . . . 25.0 111.25 -173.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.49 -20.23 60.73 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.886 -0.509 . . . . 25.0 109.772 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 p -84.21 -10.34 57.79 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.388 0.514 . . . . 25.0 112.388 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.42 36.15 15.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.631 0.772 . . . . 25.0 110.136 -171.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.4 t0 61.03 34.01 19.43 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.834 1.42 . . . . 25.0 114.834 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -119.26 135.2 54.81 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.952 -0.468 . . . . 25.0 111.658 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.8 p -61.05 -35.93 78.24 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -72.15 -7.27 48.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.239 0.542 . . . . 25.0 112.408 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.681 ' HA ' HD13 ' A' ' 59' ' ' LEU . 15.2 m-85 -120.39 12.26 11.63 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 107.024 -1.473 . . . . 25.0 107.024 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -72.23 -34.67 68.48 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.151 -0.968 . . . . 25.0 110.117 -175.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -70.09 -17.3 63.21 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 122.023 0.916 . . . . 25.0 110.011 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.2 -4.98 59.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.632 -0.877 . . . . 25.0 108.632 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -113.17 -32.06 6.43 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.096 0.474 . . . . 25.0 111.783 173.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -93.89 115.58 27.97 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.721 -0.612 . . . . 25.0 110.388 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.438 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -126.6 161.0 29.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.163 0.506 . . . . 25.0 109.792 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -118.2 161.99 32.14 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 100.45 -3.907 . . . . 25.0 100.45 162.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.02 -1.65 9.04 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 116.983 -1.545 . . . . 25.0 115.852 -174.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.7 t -127.97 12.57 6.72 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.734 0.778 . . . . 25.0 111.031 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -78.96 -30.06 44.3 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.306 -0.871 . . . . 25.0 113.121 -176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.438 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.1 m95 -124.81 165.23 18.38 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 110.309 -0.256 . . . . 25.0 110.309 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -66.44 127.62 33.0 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.454 -2.054 . . . . 25.0 105.454 170.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -101.68 107.96 19.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 100.418 -3.919 . . . . 25.0 100.418 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.19 135.37 53.38 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.915 -1.039 . . . . 25.0 110.139 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -90.41 100.89 13.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.596 -1.261 . . . . 25.0 107.596 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.1 mt -130.24 173.94 10.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.756 -1.572 . . . . 25.0 106.756 -176.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -115.26 166.46 11.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.654 0.74 . . . . 25.0 112.811 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.425 HG21 ' HA ' ' A' ' 139' ' ' ALA . 75.3 p -77.04 171.02 15.47 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.461 -1.681 . . . . 25.0 106.461 173.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.36 -162.53 33.49 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 120.585 -0.817 . . . . 25.0 111.452 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.57 131.29 39.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 118.82 1.31 . . . . 25.0 114.628 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -136.07 159.34 42.01 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.693 -1.966 . . . . 25.0 105.693 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.1 p -99.18 151.01 21.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.307 -1.368 . . . . 25.0 107.307 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -138.72 101.05 4.23 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.8 122.69 46.26 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.481 -0.933 . . . . 25.0 108.481 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -108.22 147.51 31.26 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.8 -1.091 . . . . 25.0 109.399 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -126.73 115.12 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.089 -2.559 . . . . 25.0 104.089 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -113.91 132.91 55.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.384 -0.825 . . . . 25.0 111.411 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.8 t -93.06 6.15 48.97 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.428 0.632 . . . . 25.0 109.992 173.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -118.48 138.33 52.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.026 0.441 . . . . 25.0 110.431 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -91.19 -9.19 46.3 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.635 0.606 . . . . 25.0 112.635 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -68.1 157.38 35.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.259 0.466 . . . . 25.0 112.259 -176.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.1 t -75.59 155.97 35.41 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 114.631 1.345 . . . . 25.0 114.631 -172.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.3 t -97.63 158.91 15.24 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.198 -0.91 . . . . 25.0 108.664 173.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -118.02 -15.24 9.94 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.149 0.281 . . . . 25.0 111.63 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 t -171.89 154.13 3.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.009 0.433 . . . . 25.0 111.507 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -127.13 142.01 51.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.537 -2.394 . . . . 25.0 104.537 167.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -147.12 154.57 41.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.668 -0.864 . . . . 25.0 108.668 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -137.96 136.79 37.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 106.379 -1.712 . . . . 25.0 106.379 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.98 161.87 41.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.284 0.493 . . . . 25.0 110.065 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.88 165.79 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 113.927 1.084 . . . . 25.0 113.927 -167.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -79.94 161.13 25.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 169.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.72 158.88 38.4 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.197 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.07 -19.15 39.78 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 117.4 -1.267 . . . . 25.0 114.231 -174.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -120.81 31.92 6.2 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 122.764 0.426 . . . . 25.0 111.554 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.493 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.7 p-90 -73.68 164.39 26.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.934 0.874 . . . . 25.0 112.68 -177.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.18 101.0 10.92 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.657 -1.156 . . . . 25.0 109.847 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.493 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.2 15.96 5.69 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.656 2.095 . . . . 25.0 116.656 -169.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.5 t -125.57 9.01 7.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.754 0.788 . . . . 25.0 109.12 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.7 156.18 41.92 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 114.585 -1.189 . . . . 25.0 107.943 -174.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.74 155.43 70.54 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 O-C-N 121.953 0.449 . . . . 25.0 111.673 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.41 101.09 2.83 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.587 0.708 . . . . 25.0 112.269 -175.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.9 p -89.59 155.9 18.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.255 -1.017 . . . . 25.0 108.255 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -64.34 -26.64 68.56 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.916 -0.49 . . . . 25.0 111.232 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.05 -25.13 63.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.583 -0.735 . . . . 25.0 112.464 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.8 t -79.44 -10.31 59.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.078 0.399 . . . . 25.0 112.078 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -99.4 155.87 17.31 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 114.323 1.231 . . . . 25.0 114.323 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -94.0 94.98 8.75 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 102.251 -3.24 . . . . 25.0 102.251 161.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.5 mt -66.18 -6.39 13.36 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.812 1.412 . . . . 25.0 114.812 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.5 t -85.75 127.51 62.39 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 108.602 -0.888 . . . . 25.0 108.602 176.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.44 150.3 57.79 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 115.644 -2.437 . . . . 25.0 111.459 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -101.72 -7.79 22.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.095 0.474 . . . . 25.0 111.362 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 57.3 m -148.67 68.95 1.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 25.0 109.764 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -89.08 125.37 34.99 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.705 -0.85 . . . . 25.0 108.705 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -118.92 98.92 6.43 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.058 -2.201 . . . . 25.0 105.058 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -87.96 92.05 8.99 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.019 -0.734 . . . . 25.0 109.019 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -109.67 118.83 37.59 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 106.814 -1.55 . . . . 25.0 106.814 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.54 82.51 0.34 Allowed Glycine 0 CA--C 1.5 -0.869 0 CA-C-N 115.601 -0.727 . . . . 25.0 112.862 -169.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.03 16.37 6.26 Favored Glycine 0 C--N 1.321 -0.293 0 C-N-CA 120.982 -0.628 . . . . 25.0 113.151 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.05 103.94 4.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 121.564 0.697 . . . . 25.0 109.525 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.67 125.29 91.3 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 106.164 -1.791 . . . . 25.0 106.164 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.53 167.47 26.47 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 118.197 -0.736 . . . . 25.0 113.749 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.73 26.95 4.68 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.71 -10.15 0.62 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.82 1.648 . . . . 25.0 111.656 -173.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.4 mt-30 -131.02 152.38 50.38 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 103.838 -2.652 . . . . 25.0 103.838 170.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -141.49 94.95 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 106.421 -1.696 . . . . 25.0 106.421 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -88.14 140.94 28.98 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 104.749 -2.315 . . . . 25.0 104.749 173.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.7 166.92 27.92 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.101 -1.814 . . . . 25.0 106.101 -177.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -134.49 152.96 52.13 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.722 -2.325 . . . . 25.0 104.722 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 158.86 34.76 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.515 -1.291 . . . . 25.0 107.515 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -105.29 116.58 32.19 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.247 0.342 . . . . 25.0 111.408 -174.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 57.7 mt -77.68 131.94 69.69 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -61.64 147.1 96.16 Favored 'Trans proline' 0 C--N 1.353 0.763 0 N-CA-C 113.762 0.639 . . . . 25.0 113.762 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.425 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.74 -27.26 40.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.079 -0.964 . . . . 25.0 112.696 -169.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -83.99 9.77 11.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.62 -0.718 . . . . 25.0 110.185 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -116.2 50.42 1.04 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 172.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 42.3 p -86.07 160.49 19.28 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 175.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 94.4 -168.49 28.24 Favored Glycine 0 C--O 1.237 0.326 0 N-CA-C 114.285 0.474 . . . . 25.0 114.285 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.5 t -86.14 114.89 23.35 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.352 0.596 . . . . 25.0 111.181 -169.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.9 p-80 -160.0 171.7 18.87 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.75 -0.659 . . . . 25.0 110.257 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -107.15 151.6 8.99 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 107.757 -1.201 . . . . 25.0 107.757 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.1 mt -132.93 121.9 45.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.57 129.87 52.6 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.635 -0.712 . . . . 25.0 109.748 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -114.6 130.82 56.82 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 108.973 -0.751 . . . . 25.0 108.973 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 1.7 p -125.46 137.55 57.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 122.043 0.925 . . . . 25.0 112.637 -177.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -111.92 118.46 35.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.77 -1.559 . . . . 25.0 106.954 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -98.63 125.31 43.87 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.539 -0.911 . . . . 25.0 108.539 178.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 21.7 mm -80.55 141.59 15.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.309 -0.626 . . . . 25.0 109.309 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.35 21.65 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.723 0.692 . . . . 25.0 110.476 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.01 -23.72 65.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.993 1.108 . . . . 25.0 113.993 -171.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.2 p -138.95 168.62 19.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.958 0.885 . . . . 25.0 110.248 -174.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.76 28.74 0.33 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.348 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -99.11 145.78 26.8 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.964 0.727 . . . . 25.0 112.964 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.3 146.13 15.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.279 -2.119 . . . . 25.0 105.279 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -148.16 138.11 22.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 111.87 0.322 . . . . 25.0 111.87 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.03 113.22 25.02 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 123.735 0.647 . . . . 25.0 111.205 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -97.06 111.9 23.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.981 -0.748 . . . . 25.0 108.981 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.42 141.13 30.19 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.467 0.543 . . . . 25.0 112.467 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . 0.418 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.3 tt -125.94 135.45 63.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 105.637 -1.986 . . . . 25.0 105.637 166.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -94.43 131.63 39.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.17 -1.419 . . . . 25.0 107.17 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.8 m -132.17 162.01 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.807 0.669 . . . . 25.0 112.807 -175.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -119.74 95.0 4.59 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.392 -2.447 . . . . 25.0 104.392 169.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.17 162.75 14.53 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 112.903 0.705 . . . . 25.0 112.903 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.4 p -145.92 161.1 40.81 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.425 -0.954 . . . . 25.0 108.425 174.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.888 -0.577 . . . . 25.0 110.558 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.476 0.655 . . . . 25.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.17 168.99 37.14 Favored Glycine 0 CA--C 1.509 -0.293 1 N-CA-C 101.691 -4.564 . . . . 25.0 101.691 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 p90 -146.83 165.06 30.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.318 2.059 . . . . 25.0 110.583 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.65 123.33 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.199 -1.037 . . . . 25.0 108.199 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.09 -43.08 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.63 -1.168 . . . . 25.0 109.883 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 t -154.24 129.2 4.94 Favored Pre-proline 0 C--N 1.321 -0.666 0 N-CA-C 106.35 -1.722 . . . . 25.0 106.35 177.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.404 ' HB2' HD13 ' A' ' 164' ' ' ILE . 67.3 Cg_endo -65.17 131.25 12.46 Favored 'Cis proline' 0 CA--C 1.532 0.418 0 C-N-CA 128.903 0.793 . . . . 25.0 110.92 -0.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.93 112.4 4.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.023 -0.535 . . . . 25.0 112.129 -172.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.9 t -72.23 157.84 36.98 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 107.566 -1.272 . . . . 25.0 107.566 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -55.48 -25.06 34.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.138 0.575 . . . . 25.0 112.238 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.61 -53.48 46.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.807 0.813 . . . . 25.0 109.447 175.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -70.39 -32.46 70.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.63 -0.714 . . . . 25.0 110.925 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -63.51 -32.4 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.847 -0.533 . . . . 25.0 110.374 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -40.3 96.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.38 0.609 . . . . 25.0 109.47 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -66.18 -36.15 82.32 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.887 -0.597 . . . . 25.0 110.206 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -78.24 5.3 10.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 25.0 111.518 177.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 58.35 24.45 11.66 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.158 1.383 . . . . 25.0 112.69 -179.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 19' ' ' ASN . 94.6 mt -89.74 -21.65 22.57 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.933 -1.136 . . . . 25.0 107.933 174.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.464 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.93 159.12 28.94 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 106.581 -1.637 . . . . 25.0 106.581 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.2 p -133.04 176.51 8.43 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -175.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 71.94 0.09 3.41 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.624 1.713 . . . . 25.0 115.624 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.1 m -65.95 -43.33 88.29 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 121.633 -0.667 . . . . 25.0 111.745 175.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.73 -63.24 1.94 Allowed Glycine 0 C--O 1.218 -0.891 0 O-C-N 123.598 0.561 . . . . 25.0 111.939 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -87.67 -51.46 5.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.989 0.899 . . . . 25.0 111.857 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.3 t -66.66 -13.2 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.177 -0.92 . . . . 25.0 113.235 -172.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.87 -4.99 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.436 -0.79 . . . . 25.0 111.857 178.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -112.56 -34.07 5.95 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 25.0 109.515 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.3 100.45 29.46 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.399 -0.593 . . . . 25.0 109.399 172.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.1 -19.87 22.34 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.758 -1.028 . . . . 25.0 113.793 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -88.82 15.78 7.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.187 0.439 . . . . 25.0 112.187 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 71.2 m -63.22 -23.13 67.29 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.978 0.418 . . . . 25.0 111.585 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 4.4 m -64.04 122.0 14.1 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 115.371 1.619 . . . . 25.0 115.371 -175.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -152.88 159.04 42.98 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 174.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.03 -165.48 17.02 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 108.333 -1.907 . . . . 25.0 108.333 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.04 148.09 45.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.437 1.118 . . . . 25.0 112.546 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -67.27 156.87 35.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.336 -1.357 . . . . 25.0 107.336 171.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.32 -3.49 1.91 Allowed Glycine 0 C--O 1.224 -0.522 0 CA-C-N 114.816 -1.084 . . . . 25.0 112.309 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -75.93 144.06 75.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 O-C-N 121.826 -0.809 . . . . 25.0 108.861 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -91.48 -17.32 15.96 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 N-CA-C 115.581 1.339 . . . . 25.0 115.581 -5.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -70.67 -35.34 72.79 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.73 1.381 . . . . 25.0 114.73 -169.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -119.01 35.14 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.547 -2.02 . . . . 25.0 105.547 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.12 177.21 47.57 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.617 -1.174 . . . . 25.0 111.691 -177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.94 172.2 4.15 Favored 'Trans proline' 0 C--O 1.241 0.635 0 C-N-CA 123.924 3.082 . . . . 25.0 113.821 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.96 159.86 31.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.789 -1.56 . . . . 25.0 106.789 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.17 138.68 57.86 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.258 -1.337 . . . . 25.0 107.438 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.08 -4.7 82.48 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.258 -0.496 . . . . 25.0 113.063 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.406 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.2 m170 -124.27 9.27 8.55 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.253 -0.647 . . . . 25.0 109.253 178.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.3 mt -64.87 -49.49 79.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.703 -0.226 . . . . 25.0 111.259 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.58 -29.3 63.4 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 p -77.54 -8.29 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.596 0.962 . . . . 25.0 113.596 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.52 34.26 18.02 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.641 0.776 . . . . 25.0 109.816 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.29 38.51 26.02 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.956 1.465 . . . . 25.0 114.956 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -119.67 134.73 55.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.106 0.562 . . . . 25.0 111.108 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 p -62.29 -34.7 77.09 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.915 1.82 . . . . 25.0 115.915 -173.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' H ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -70.42 -7.66 44.86 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.251 0.548 . . . . 25.0 112.437 -177.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.695 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.8 m-85 -122.51 14.23 10.25 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 107.521 -1.289 . . . . 25.0 107.521 -178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.49 -38.17 71.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.227 -0.921 . . . . 25.0 110.405 -176.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -71.5 -17.34 62.35 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 122.032 0.92 . . . . 25.0 109.345 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.2 mp -83.61 -5.94 59.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.553 -0.906 . . . . 25.0 108.553 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -111.82 -32.06 6.74 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -96.58 116.45 29.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 121.471 -0.768 . . . . 25.0 111.127 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.459 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -122.64 160.55 25.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.881 -0.6 . . . . 25.0 109.466 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 6.1 p -116.93 162.57 26.78 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 100.541 -3.874 . . . . 25.0 100.541 162.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.55 -5.38 15.1 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 116.852 -1.632 . . . . 25.0 115.763 -175.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 t -125.67 12.38 7.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.291 0.567 . . . . 25.0 111.419 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -77.67 -29.44 51.55 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.817 0.673 . . . . 25.0 112.817 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.459 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.0 m95 -126.8 168.07 14.93 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 120.674 0.273 . . . . 25.0 110.505 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.0 t-20 -66.77 131.02 45.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 105.436 -2.061 . . . . 25.0 105.436 168.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -104.94 108.09 19.41 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 100.587 -3.857 . . . . 25.0 100.587 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.0 135.83 54.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 114.891 -1.05 . . . . 25.0 110.178 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -92.56 100.22 12.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.626 -1.17 . . . . 25.0 107.91 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.78 173.88 10.71 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.132 -1.803 . . . . 25.0 106.132 -176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -116.09 166.18 12.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.629 0.974 . . . . 25.0 113.629 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.408 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.3 p -77.04 169.14 18.87 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 174.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.96 -162.25 28.6 Favored Glycine 0 C--O 1.241 0.544 0 N-CA-C 111.078 -0.809 . . . . 25.0 111.078 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.08 133.32 52.46 Favored 'Trans proline' 0 C--N 1.346 0.422 0 CA-C-N 118.889 1.345 . . . . 25.0 114.212 -177.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -138.38 161.62 36.5 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.438 -1.69 . . . . 25.0 106.438 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -104.63 152.29 22.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.216 -1.401 . . . . 25.0 107.216 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -140.77 100.95 3.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.06 -1.83 . . . . 25.0 106.06 -176.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.46 113.8 27.58 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.83 0.824 . . . . 25.0 109.657 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.9 m95 -105.34 152.96 22.28 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.432 -0.804 . . . . 25.0 110.765 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -128.14 114.16 16.65 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.2 mp -115.85 104.92 12.11 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.297 -0.865 . . . . 25.0 112.812 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.9 t -70.91 -22.82 62.2 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.832 -0.803 . . . . 25.0 108.832 171.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.1 98.96 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 175.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -70.04 -18.9 63.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.297 1.221 . . . . 25.0 114.297 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -78.84 167.11 21.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.671 0.619 . . . . 25.0 112.671 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.6 t -64.54 155.54 32.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 117.254 2.316 . . . . 25.0 117.254 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 t -103.52 158.83 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 172.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.97 -12.76 10.07 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.398 0.518 . . . . 25.0 112.398 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.2 t -171.4 151.93 3.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.019 0.438 . . . . 25.0 112.171 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.5 m95 -127.23 139.76 52.69 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.105 -2.554 . . . . 25.0 104.105 167.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -145.82 144.59 30.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.37 -1.344 . . . . 25.0 107.37 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -133.86 134.47 42.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -149.29 163.13 38.56 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.556 -0.535 . . . . 25.0 109.556 178.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.85 165.12 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 113.685 0.994 . . . . 25.0 113.685 -168.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 16.6 p -79.11 161.69 26.33 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 169.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -61.14 159.04 31.54 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 25.0 109.205 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.72 -25.24 34.01 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 116.096 -2.136 . . . . 25.0 113.314 -175.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -114.43 32.06 6.2 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.034 0.534 . . . . 25.0 110.632 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.9 p-90 -73.24 167.41 21.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 122.029 0.918 . . . . 25.0 113.032 -176.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -83.16 101.08 10.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.447 -1.251 . . . . 25.0 109.59 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -93.48 8.56 40.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 14.1 t -118.03 9.76 12.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.401 -0.963 . . . . 25.0 108.401 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -115.11 157.76 42.72 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.115 -1.402 . . . . 25.0 107.599 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -65.67 157.46 58.55 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 O-C-N 121.982 0.464 . . . . 25.0 111.226 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.93 100.95 2.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.227 0.537 . . . . 25.0 111.722 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.1 p -89.31 156.99 18.37 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.305 -1.368 . . . . 25.0 107.305 174.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.66 -24.93 66.35 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.44 0.638 . . . . 25.0 110.762 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.7 -25.96 64.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.996 -1.002 . . . . 25.0 112.914 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 m -80.6 -8.34 59.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 25.0 112.396 -177.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 41.9 m-85 -98.13 154.28 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 115.158 1.54 . . . . 25.0 115.158 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -97.02 96.44 8.48 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 102.614 -3.106 . . . . 25.0 102.614 162.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.92 -7.28 20.94 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -169.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -80.65 132.28 58.56 Favored Pre-proline 0 C--N 1.323 -0.58 0 N-CA-C 109.122 -0.696 . . . . 25.0 109.122 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -73.74 152.3 47.33 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 115.069 -2.821 . . . . 25.0 111.082 177.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -107.46 -11.41 15.51 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.988 0.423 . . . . 25.0 111.49 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.3 m -149.32 67.91 1.03 Allowed 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.317 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.58 138.99 30.99 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.126 -1.03 . . . . 25.0 108.738 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.79 101.04 5.71 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 104.715 -2.328 . . . . 25.0 104.715 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -94.56 92.19 6.95 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.5 -0.926 . . . . 25.0 108.5 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -108.55 122.08 46.31 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 107.067 -1.457 . . . . 25.0 107.067 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.39 37.74 3.4 Favored Glycine 0 C--O 1.224 -0.489 0 N-CA-C 117.129 1.612 . . . . 25.0 117.129 -168.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 162.38 23.92 0.02 OUTLIER Glycine 0 C--N 1.319 -0.389 0 C-N-CA 120.354 -0.927 . . . . 25.0 113.452 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.62 104.16 9.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.381 0.61 . . . . 25.0 110.323 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 91.4 mt -75.47 123.57 88.62 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 104.894 -2.262 . . . . 25.0 104.894 173.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.75 165.34 33.01 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 117.725 -1.05 . . . . 25.0 113.577 -175.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.415 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.8 26.33 3.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 175.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.64 -8.43 0.92 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.987 1.715 . . . . 25.0 111.228 -173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.9 mt-30 -135.04 153.65 51.98 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.064 -2.569 . . . . 25.0 104.064 171.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.72 95.28 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.71 141.94 29.37 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 104.058 -2.571 . . . . 25.0 104.058 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.32 167.03 31.33 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.549 -1.659 . . . . 25.0 109.323 -176.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -134.54 157.38 46.69 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.655 -1.609 . . . . 25.0 106.655 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.46 160.89 26.8 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -108.22 114.98 29.28 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.333 0.396 . . . . 25.0 111.316 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.3 mt -78.58 132.76 64.36 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.68 -0.859 . . . . 25.0 108.68 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -62.35 147.44 94.94 Favored 'Trans proline' 0 C--N 1.354 0.841 0 CA-C-N 118.741 0.586 . . . . 25.0 113.611 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.408 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.55 -26.25 35.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 25.0 112.895 -169.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 p-10 -84.0 9.02 13.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 25.0 110.055 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -116.54 53.43 0.88 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 172.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.5 p -86.91 168.35 13.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 106.525 -1.657 . . . . 25.0 106.525 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 89.67 -167.55 33.76 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 115.535 0.974 . . . . 25.0 115.535 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.2 t -85.84 107.99 17.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.315 0.579 . . . . 25.0 110.707 -169.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -157.12 171.45 20.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.875 -0.602 . . . . 25.0 110.866 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.24 151.25 9.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 N-CA-C 107.816 -1.179 . . . . 25.0 107.816 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.8 mt -131.88 120.64 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 104.758 -2.312 . . . . 25.0 104.758 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.95 130.38 50.0 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.744 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.27 122.27 42.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.487 -0.931 . . . . 25.0 108.487 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.33 140.24 36.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 122.077 0.942 . . . . 25.0 110.197 -178.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -124.25 122.21 37.15 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.25 129.43 50.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 123.238 0.615 . . . . 25.0 109.963 -175.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 43.7 mm -78.06 140.93 16.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.681 -0.489 . . . . 25.0 109.681 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.41 -44.27 25.29 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.773 0.715 . . . . 25.0 111.027 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.26 -23.03 64.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 114.659 1.355 . . . . 25.0 114.659 -172.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.6 p -139.29 170.88 15.13 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.921 0.867 . . . . 25.0 109.707 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.82 23.06 0.56 Allowed 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.365 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -94.2 143.75 26.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.593 -0.692 . . . . 25.0 112.822 -176.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.28 145.58 16.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 104.647 -2.353 . . . . 25.0 104.647 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -147.52 140.01 24.63 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.083 0.771 . . . . 25.0 113.083 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -94.63 112.3 24.05 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.63 0.772 . . . . 25.0 111.496 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -97.06 108.21 20.9 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.38 141.08 29.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.311 -0.859 . . . . 25.0 111.83 -176.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . 0.404 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.4 tt -125.58 134.59 66.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.187 -1.783 . . . . 25.0 106.187 167.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.34 130.67 39.02 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.317 -1.364 . . . . 25.0 107.317 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.3 m -131.54 161.19 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 112.81 0.67 . . . . 25.0 112.81 -175.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -118.67 95.1 4.71 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 104.059 -2.571 . . . . 25.0 104.059 168.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -93.14 160.42 14.85 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 113.172 0.804 . . . . 25.0 113.172 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 65.6 p -145.97 167.17 23.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.77 -0.826 . . . . 25.0 108.77 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.869 -0.586 . . . . 25.0 109.94 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.8 m80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.248 -0.278 . . . . 25.0 110.248 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.01 170.59 12.9 Favored Glycine 0 C--N 1.322 -0.201 0 N-CA-C 103.507 -3.837 . . . . 25.0 103.507 -172.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -148.85 169.92 19.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 119.594 1.697 . . . . 25.0 111.385 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 126.11 62.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.031 -1.47 . . . . 25.0 107.031 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.64 -43.01 49.91 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.388 -0.824 . . . . 25.0 109.408 -175.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -153.56 133.57 7.62 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 105.503 -2.036 . . . . 25.0 105.503 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -65.25 135.46 23.53 Favored 'Cis proline' 0 CA--C 1.533 0.469 0 C-N-CA 128.754 0.731 . . . . 25.0 111.999 0.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.17 107.36 1.92 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.773 -0.649 . . . . 25.0 112.431 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 t -71.85 156.69 39.01 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.634 -0.506 . . . . 25.0 109.634 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 -55.4 -25.93 38.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.815 0.846 . . . . 25.0 112.444 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.25 -53.36 45.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.798 0.809 . . . . 25.0 109.134 175.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -66.37 -33.92 76.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.506 -0.77 . . . . 25.0 110.84 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.17 -33.2 75.24 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.948 -0.47 . . . . 25.0 110.244 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -37.52 84.83 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 178.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -62.66 -39.22 93.24 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.257 0.551 . . . . 25.0 109.857 175.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.2 mt -77.45 5.12 9.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.025 -0.534 . . . . 25.0 112.117 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 58.62 22.13 9.48 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.115 1.366 . . . . 25.0 112.814 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.478 ' C ' HD22 ' A' ' 19' ' ' ASN . 95.1 mt -85.2 -20.16 30.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.895 -1.15 . . . . 25.0 107.895 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.478 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -121.81 156.72 32.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.314 -1.735 . . . . 25.0 106.314 177.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 p -134.58 175.98 9.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.366 -0.605 . . . . 25.0 109.366 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 68.08 5.01 4.36 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 175.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.2 m -67.25 -33.15 74.73 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 121.451 -0.781 . . . . 25.0 111.777 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.66 -62.61 1.55 Allowed Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.733 0.645 . . . . 25.0 112.376 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 t -91.75 -50.81 5.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 114.945 1.461 . . . . 25.0 114.945 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.98 -14.28 13.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.122 -1.399 . . . . 25.0 114.12 -165.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -79.45 -7.6 58.53 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.574 -0.85 . . . . 25.0 112.382 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -104.14 -38.92 6.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.229 -0.988 . . . . 25.0 111.048 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -131.21 95.98 23.2 Favored Pre-proline 0 C--O 1.241 0.641 0 N-CA-C 111.785 0.291 . . . . 25.0 111.785 168.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.26 -19.06 29.73 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 116.91 -1.593 . . . . 25.0 115.383 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -81.42 5.57 17.2 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 121.575 -0.703 . . . . 25.0 112.178 -178.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.4 m -66.45 -12.35 56.78 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.77 0.656 . . . . 25.0 112.77 177.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.05 132.88 29.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.881 0.848 . . . . 25.0 112.782 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -152.98 150.42 29.21 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.64 -168.38 17.92 Favored Glycine 0 CA--C 1.51 -0.261 0 N-CA-C 109.504 -1.439 . . . . 25.0 109.504 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -127.92 146.64 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.764 0.782 . . . . 25.0 111.174 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.98 157.01 29.42 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.176 -1.046 . . . . 25.0 108.176 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.27 -4.0 1.99 Allowed Glycine 0 C--N 1.318 -0.451 0 CA-C-N 114.726 -1.124 . . . . 25.0 112.847 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -75.96 148.09 81.29 Favored Pre-proline 0 C--N 1.321 -0.632 0 O-C-N 121.623 -0.928 . . . . 25.0 109.075 -177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -90.8 -18.64 14.53 Favored 'Cis proline' 0 CA--C 1.541 0.875 0 N-CA-C 115.95 1.481 . . . . 25.0 115.95 -4.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -77.77 -35.8 51.28 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.924 1.453 . . . . 25.0 114.924 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.02 33.27 5.33 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.364 -1.717 . . . . 25.0 106.364 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.07 -174.86 45.26 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.626 -1.17 . . . . 25.0 111.415 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -60.44 171.5 3.3 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 123.793 2.995 . . . . 25.0 113.322 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.14 159.98 30.99 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.23 137.38 58.0 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 106.652 -1.61 . . . . 25.0 106.652 176.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.21 -6.04 82.7 Favored Glycine 0 CA--C 1.509 -0.298 0 CA-C-O 121.416 0.453 . . . . 25.0 113.413 -174.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 51.0 m170 -125.02 10.04 8.15 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.404 -0.468 . . . . 25.0 110.218 179.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.8 mt -64.23 -48.77 84.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.443 -0.16 . . . . 25.0 111.232 -173.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.81 -24.34 55.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.072 0.463 . . . . 25.0 110.004 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.3 p -81.62 -8.61 59.73 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.031 0.752 . . . . 25.0 113.031 -176.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.89 34.79 17.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.714 0.805 . . . . 25.0 110.075 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.416 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.44 41.11 23.33 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -177.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -121.34 135.01 55.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.287 0.635 . . . . 25.0 110.781 174.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.56 -34.44 77.81 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 115.497 1.665 . . . . 25.0 115.497 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 t -71.42 -8.05 51.32 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.347 0.594 . . . . 25.0 112.346 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.705 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.3 m-85 -119.1 15.02 13.22 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.447 -1.316 . . . . 25.0 107.447 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.81 -37.89 70.31 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.1 -1.0 . . . . 25.0 110.401 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.4 mp0 -70.2 -16.31 63.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.879 0.847 . . . . 25.0 110.042 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.4 mp -86.16 -5.72 59.14 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -112.49 -32.31 6.52 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.104 0.409 . . . . 25.0 112.104 173.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -96.07 121.89 38.32 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 121.628 -0.67 . . . . 25.0 110.185 -178.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.453 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -128.03 160.87 30.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.504 -0.771 . . . . 25.0 109.731 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.3 p -114.39 161.19 29.75 Favored Pre-proline 0 C--N 1.319 -0.74 1 N-CA-C 100.11 -4.033 . . . . 25.0 100.11 161.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 -2.16 9.67 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 116.961 -1.56 . . . . 25.0 115.765 -174.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -127.34 11.73 6.94 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.231 0.539 . . . . 25.0 111.65 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -78.93 -31.05 45.05 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.028 0.751 . . . . 25.0 113.028 -176.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.9 m95 -122.58 167.17 13.73 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 110.047 -0.353 . . . . 25.0 110.047 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -68.19 125.0 24.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.009 -1.848 . . . . 25.0 106.009 172.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -100.44 106.11 17.65 Favored 'General case' 0 CA--C 1.5 -0.981 0 N-CA-C 100.511 -3.885 . . . . 25.0 100.511 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.32 135.75 52.36 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.97 -1.014 . . . . 25.0 110.81 -176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -88.89 100.84 13.49 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 107.912 -1.144 . . . . 25.0 107.912 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.77 174.05 10.33 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.883 -1.895 . . . . 25.0 105.883 -177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -115.42 166.51 11.8 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.687 0.995 . . . . 25.0 113.687 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 72.5 p -77.12 171.61 14.55 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 106.297 -1.742 . . . . 25.0 106.297 173.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.99 -161.35 33.05 Favored Glycine 0 C--O 1.24 0.517 0 C-N-CA 120.436 -0.888 . . . . 25.0 111.198 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.09 132.95 50.06 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 119.013 1.406 . . . . 25.0 114.392 -176.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -139.41 158.74 43.62 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.7 p -100.2 150.18 22.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -139.11 100.93 4.15 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 105.527 -2.027 . . . . 25.0 105.527 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.54 111.07 23.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.008 0.909 . . . . 25.0 111.004 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -97.8 147.42 24.41 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.305 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -124.01 110.55 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.602 -2.37 . . . . 25.0 104.602 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.44 130.91 45.74 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.166 -0.925 . . . . 25.0 109.478 -171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.7 t -72.73 -10.92 60.36 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.672 0.619 . . . . 25.0 112.672 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.98 147.6 27.35 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.805 -0.813 . . . . 25.0 108.805 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 mtm180 -81.22 13.68 2.74 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.287 0.847 . . . . 25.0 113.287 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.98 152.36 32.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.956 -0.757 . . . . 25.0 108.956 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.1 t -69.47 155.95 39.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.723 1.009 . . . . 25.0 113.723 -170.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.477 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 3.1 t -102.19 156.55 17.49 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.276 -1.379 . . . . 25.0 107.276 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.84 -15.94 10.0 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.168 0.293 . . . . 25.0 110.771 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 t -172.54 152.08 2.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.891 0.377 . . . . 25.0 111.975 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.67 140.71 52.72 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 103.687 -2.709 . . . . 25.0 103.687 166.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -145.82 150.97 37.15 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.089 0.859 . . . . 25.0 108.978 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -137.98 137.49 37.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.084 -1.821 . . . . 25.0 106.084 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -147.88 160.09 43.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.24 164.5 34.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.217 0.821 . . . . 25.0 113.217 -168.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 p -79.76 162.51 25.1 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.434 -0.95 . . . . 25.0 108.434 171.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -64.06 161.87 35.81 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.249 -0.887 . . . . 25.0 109.472 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.59 -18.73 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 116.505 -1.863 . . . . 25.0 113.812 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.83 32.01 6.16 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.129 0.571 . . . . 25.0 111.034 -177.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.475 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 10.4 p-90 -68.94 172.68 6.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.293 1.22 . . . . 25.0 114.293 -176.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -83.11 98.41 9.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.0 -1.0 . . . . 25.0 109.099 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.475 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -96.27 5.3 51.28 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.913 1.82 . . . . 25.0 115.913 -168.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -128.42 17.22 6.5 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -122.53 161.0 45.99 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 114.195 -1.366 . . . . 25.0 107.503 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.96 151.92 82.05 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 118.443 -0.571 . . . . 25.0 111.133 173.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 108.81 3.44 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.554 0.575 . . . . 25.0 112.554 -175.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.7 p -95.66 153.31 17.79 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.126 -1.065 . . . . 25.0 108.126 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -68.13 -22.59 64.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.422 0.63 . . . . 25.0 110.111 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.81 -29.65 68.87 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.943 -1.026 . . . . 25.0 112.28 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.76 -3.04 59.0 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.045 0.387 . . . . 25.0 112.045 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -100.01 152.27 20.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 114.021 1.119 . . . . 25.0 114.021 -177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -97.02 92.85 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.632 -2.729 . . . . 25.0 103.632 165.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.0 mt -66.66 -6.49 15.72 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.564 1.32 . . . . 25.0 114.564 -170.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.43 122.02 78.69 Favored Pre-proline 0 C--N 1.323 -0.543 0 N-CA-C 108.856 -0.794 . . . . 25.0 108.856 176.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.85 135.6 28.22 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 115.26 -2.693 . . . . 25.0 111.945 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -87.0 -13.62 43.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 -175.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.2 m -146.55 63.32 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.508 -0.314 . . . . 25.0 111.828 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -89.07 134.92 33.82 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 118.152 -1.419 . . . . 25.0 108.874 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -122.58 98.99 6.17 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 104.239 -2.504 . . . . 25.0 104.239 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -90.32 92.05 8.75 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.045 -1.095 . . . . 25.0 108.045 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -106.31 122.06 45.49 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.75 84.11 0.39 Allowed Glycine 0 CA--C 1.504 -0.602 0 CA-C-N 115.123 -0.944 . . . . 25.0 112.811 -171.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.56 15.63 13.31 Favored Glycine 0 C--N 1.32 -0.337 0 C-N-CA 120.901 -0.666 . . . . 25.0 113.464 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.13 106.73 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.366 -0.976 . . . . 25.0 108.366 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 79.2 mt -72.48 117.58 60.2 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 107.583 -1.266 . . . . 25.0 107.583 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -76.94 166.89 26.11 Favored 'Trans proline' 0 C--N 1.345 0.35 0 N-CA-C 114.682 0.993 . . . . 25.0 114.682 -176.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.44 26.39 4.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.763 -0.829 . . . . 25.0 108.763 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.72 -16.89 0.37 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.688 1.595 . . . . 25.0 112.33 -175.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -129.31 146.96 51.11 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 103.988 -2.597 . . . . 25.0 103.988 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.8 t -138.71 95.03 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -89.26 132.66 34.79 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 104.662 -2.348 . . . . 25.0 104.662 173.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -145.2 166.98 23.88 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -175.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -132.11 156.39 46.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.85 159.87 33.03 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -104.67 119.03 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.08 0.238 . . . . 25.0 111.191 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.27 132.81 61.7 Favored Pre-proline 0 C--O 1.24 0.6 0 N-CA-C 108.276 -1.009 . . . . 25.0 108.276 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -60.64 147.41 94.83 Favored 'Trans proline' 0 C--N 1.354 0.844 0 N-CA-C 113.84 0.669 . . . . 25.0 113.84 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.41 -26.46 35.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.159 -0.928 . . . . 25.0 112.717 -169.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -83.63 10.35 9.4 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.744 0.783 . . . . 25.0 110.208 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -115.97 51.4 0.96 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.43 -0.952 . . . . 25.0 108.43 172.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.4 p -86.24 162.22 18.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.582 -1.636 . . . . 25.0 106.582 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.6 -165.68 29.9 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 114.839 0.696 . . . . 25.0 114.839 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 37.4 t -85.85 110.85 19.68 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.491 0.662 . . . . 25.0 110.954 -168.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -157.39 170.98 21.22 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 115.72 -0.673 . . . . 25.0 110.493 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.63 151.54 11.88 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 107.725 -1.213 . . . . 25.0 107.725 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 58.8 mt -131.55 121.27 47.7 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 104.809 -2.293 . . . . 25.0 104.809 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -103.05 128.76 49.8 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.663 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.43 131.59 56.27 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 123.005 0.522 . . . . 25.0 109.804 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.42 145.76 34.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 122.125 0.965 . . . . 25.0 112.249 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.477 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 12.7 t90 -116.77 119.37 35.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 173.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.81 121.41 38.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 7.4 mm -77.28 143.51 12.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.156 -1.053 . . . . 25.0 108.156 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.54 -41.02 28.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.847 0.749 . . . . 25.0 109.637 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.16 -22.69 64.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.011 1.115 . . . . 25.0 114.011 -172.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -138.5 169.14 18.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.993 0.902 . . . . 25.0 110.236 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 17.96 1.45 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.162 -0.926 . . . . 25.0 111.969 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -90.03 144.65 25.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.915 0.709 . . . . 25.0 112.915 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.49 141.34 14.62 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.089 -2.189 . . . . 25.0 105.089 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -146.51 131.85 18.55 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 117.766 0.257 . . . . 25.0 111.432 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -89.95 117.32 28.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.955 -0.566 . . . . 25.0 110.916 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -96.96 107.99 20.62 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.1 140.79 32.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.641 -0.709 . . . . 25.0 111.999 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 134.4 66.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.404 -1.702 . . . . 25.0 106.404 168.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -92.47 132.21 36.98 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.886 -1.153 . . . . 25.0 107.886 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -133.54 161.74 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -176.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -120.64 95.0 4.54 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.637 -2.357 . . . . 25.0 104.637 169.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.58 160.1 16.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 113.277 0.843 . . . . 25.0 113.277 -170.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.4 p -145.8 166.58 25.51 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.821 -0.437 . . . . 25.0 109.821 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.709 -0.662 . . . . 25.0 110.333 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 47.0 m170 . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.963 0.411 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.66 30.97 Favored Glycine 0 N--CA 1.45 -0.377 1 N-CA-C 102.709 -4.156 . . . . 25.0 102.709 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -147.32 168.52 21.57 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 119.523 1.662 . . . . 25.0 109.276 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -105.28 122.83 59.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 108.147 -1.057 . . . . 25.0 108.147 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -72.22 -42.69 65.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.845 -1.071 . . . . 25.0 109.697 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 t -153.02 129.24 5.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -64.67 134.46 19.29 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 128.798 0.749 . . . . 25.0 111.585 -0.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 113.17 4.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.626 0.602 . . . . 25.0 112.626 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -72.11 155.03 40.73 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.104 -0.702 . . . . 25.0 109.104 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -56.74 -26.38 57.03 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.286 0.635 . . . . 25.0 112.163 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -48.41 63.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -66.38 -36.65 83.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.624 -0.716 . . . . 25.0 109.638 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.84 -33.43 75.66 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 122.228 -0.295 . . . . 25.0 110.587 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -39.64 93.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 25.0 109.96 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -66.63 -35.37 80.01 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.211 0.529 . . . . 25.0 110.071 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.4 mt -79.4 6.42 10.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.485 . . . . 25.0 111.731 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 59.09 21.45 9.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.056 1.343 . . . . 25.0 113.314 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.47 ' C ' HD22 ' A' ' 19' ' ' ASN . 92.5 mt -87.75 -20.62 25.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.996 -1.113 . . . . 25.0 107.996 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.47 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.0 m120 -123.33 158.95 29.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.075 -2.194 . . . . 25.0 105.075 176.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.1 p -135.38 174.68 10.34 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 122.307 0.243 . . . . 25.0 110.447 -175.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 69.71 5.08 5.03 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.978 1.844 . . . . 25.0 115.978 174.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.1 m -66.8 -39.25 87.69 Favored 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 121.483 -0.761 . . . . 25.0 110.491 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.87 -64.19 1.55 Allowed Glycine 0 C--O 1.217 -0.965 0 O-C-N 123.593 0.558 . . . . 25.0 112.303 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 t -88.01 -53.69 4.6 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.655 1.217 . . . . 25.0 111.592 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.2 OUTLIER -69.95 -6.9 7.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.32 -1.309 . . . . 25.0 113.377 -171.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.34 2.59 52.21 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.08 -0.387 . . . . 25.0 111.508 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -116.78 -37.93 3.54 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.4 -0.92 . . . . 25.0 111.383 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -127.51 93.68 39.99 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 122.047 0.139 . . . . 25.0 111.35 167.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' VAL . 83.5 Cg_endo -70.19 -19.33 34.23 Favored 'Trans proline' 0 C--N 1.343 0.28 0 N-CA-C 115.614 1.351 . . . . 25.0 115.614 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -82.44 4.95 22.16 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.703 -0.623 . . . . 25.0 112.398 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.1 m -68.55 -9.61 50.48 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 m -64.04 136.65 26.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 122.176 0.988 . . . . 25.0 112.916 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -153.02 160.26 42.97 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 103.742 -2.688 . . . . 25.0 103.742 177.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.84 -170.97 27.31 Favored Glycine 0 C--O 1.226 -0.389 0 N-CA-C 108.439 -1.865 . . . . 25.0 108.439 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.74 145.35 49.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 118.811 1.306 . . . . 25.0 112.142 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -66.57 156.98 33.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.24 1.66 2.81 Favored Glycine 0 C--O 1.224 -0.528 0 CA-C-N 114.921 -1.036 . . . . 25.0 113.114 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -76.06 140.86 70.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 121.633 -0.922 . . . . 25.0 108.848 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -92.66 -15.41 17.52 Favored 'Cis proline' 0 CA--C 1.544 0.993 0 N-CA-C 115.603 1.347 . . . . 25.0 115.603 -5.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.87 -36.3 72.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.878 1.436 . . . . 25.0 114.878 -169.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.15 30.21 7.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 105.612 -1.996 . . . . 25.0 105.612 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.57 -177.2 40.0 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 114.376 -1.284 . . . . 25.0 110.835 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -62.3 170.75 6.12 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.706 2.27 . . . . 25.0 113.445 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 159.95 31.1 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.381 -1.34 . . . . 25.0 107.381 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -61.41 139.08 58.26 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.767 -1.568 . . . . 25.0 106.767 174.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.52 -6.1 83.09 Favored Glycine 0 C--O 1.228 -0.228 0 CA-C-N 116.047 -0.524 . . . . 25.0 112.439 -173.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -126.2 11.19 7.54 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.53 -0.394 . . . . 25.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.28 -52.18 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 122.209 -0.307 . . . . 25.0 111.556 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.59 -21.52 57.74 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.75 -0.463 . . . . 25.0 109.75 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.6 p -81.94 -8.87 59.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.1 32.01 12.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.519 0.728 . . . . 25.0 110.292 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.94 36.83 24.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.557 1.317 . . . . 25.0 114.557 -176.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -119.82 133.31 55.64 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.927 0.491 . . . . 25.0 110.615 175.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.4 p -61.12 -33.08 72.81 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.126 1.158 . . . . 25.0 114.126 -175.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -66.24 -15.97 63.63 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.48 0.657 . . . . 25.0 112.076 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.698 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -117.25 14.31 14.78 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.744 -0.835 . . . . 25.0 108.744 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -71.16 -38.76 72.17 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.895 -1.128 . . . . 25.0 111.325 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.3 mp0 -71.31 -13.66 61.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.803 0.811 . . . . 25.0 109.677 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -88.02 -4.65 58.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.693 -0.854 . . . . 25.0 108.693 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -113.11 -32.58 6.28 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.842 0.682 . . . . 25.0 112.842 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -97.09 123.08 40.75 Favored 'General case' 0 CA--C 1.507 -0.71 0 O-C-N 121.534 -0.729 . . . . 25.0 109.845 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.44 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -124.96 160.94 27.75 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.193 -0.912 . . . . 25.0 110.006 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -119.01 161.14 37.97 Favored Pre-proline 0 C--N 1.317 -0.815 1 N-CA-C 100.087 -4.042 . . . . 25.0 100.087 163.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.41 -5.31 15.68 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 116.924 -1.584 . . . . 25.0 115.64 -174.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.6 t -124.64 10.73 8.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.198 0.523 . . . . 25.0 111.7 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -78.17 -30.14 48.95 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.726 -0.609 . . . . 25.0 112.474 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.0 m95 -123.74 165.4 17.33 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.536 0.208 . . . . 25.0 110.646 -177.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -68.12 128.51 36.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.79 -1.929 . . . . 25.0 105.79 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.5 mmtt -101.33 106.49 17.67 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 100.929 -3.73 . . . . 25.0 100.929 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.02 135.58 52.51 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.022 -0.99 . . . . 25.0 110.511 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -89.88 101.49 14.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.738 -1.119 . . . . 25.0 107.985 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -130.68 173.86 10.49 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.632 -1.247 . . . . 25.0 107.632 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -114.69 161.9 17.51 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.275 0.843 . . . . 25.0 113.275 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.445 HG21 ' HA ' ' A' ' 139' ' ' ALA . 71.3 p -78.15 172.49 13.47 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 106.593 -1.632 . . . . 25.0 106.593 171.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.37 -162.38 32.0 Favored Glycine 0 C--O 1.241 0.562 0 N-CA-C 110.825 -0.91 . . . . 25.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.62 129.91 34.67 Favored 'Trans proline' 0 C--N 1.345 0.382 0 CA-C-N 118.961 1.38 . . . . 25.0 114.514 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -138.71 160.11 40.44 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.6 p -106.44 152.34 23.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -135.82 100.93 4.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.475 -2.417 . . . . 25.0 104.475 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.89 106.99 18.02 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.304 -0.862 . . . . 25.0 110.446 -176.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -92.8 146.94 23.26 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.62 -0.718 . . . . 25.0 109.944 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -127.53 116.08 19.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 103.937 -2.616 . . . . 25.0 103.937 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -116.42 125.6 52.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.535 -0.757 . . . . 25.0 112.689 -173.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.4 t -87.62 5.33 40.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.314 0.578 . . . . 25.0 110.245 173.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.61 116.74 21.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.93 0.395 . . . . 25.0 110.366 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -79.84 2.88 21.47 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -178.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.92 153.18 42.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.698 -0.482 . . . . 25.0 109.698 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 156.01 39.72 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.533 0.938 . . . . 25.0 113.533 -172.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.0 t -99.64 158.91 15.43 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.215 -1.031 . . . . 25.0 108.215 174.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.91 -15.31 10.0 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.161 0.288 . . . . 25.0 111.25 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.6 t -171.89 153.21 3.18 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.939 0.4 . . . . 25.0 111.951 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -125.72 139.66 53.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 104.404 -2.443 . . . . 25.0 104.404 167.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -145.01 151.42 38.54 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.342 -0.984 . . . . 25.0 108.342 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -138.01 135.04 35.55 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.12 161.71 41.42 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 118.35 0.523 . . . . 25.0 109.973 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.34 162.59 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 113.757 1.021 . . . . 25.0 113.757 -167.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -76.74 161.23 28.66 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.648 -1.242 . . . . 25.0 107.648 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.93 157.52 40.16 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.147 -0.933 . . . . 25.0 110.202 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -67.75 -19.7 47.0 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 117.858 -0.961 . . . . 25.0 114.285 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -120.98 31.99 6.16 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 122.819 0.448 . . . . 25.0 111.64 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.72 163.99 27.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.942 0.877 . . . . 25.0 112.942 -176.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.33 101.02 11.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.433 -1.258 . . . . 25.0 110.348 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -86.5 17.35 3.89 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.828 2.158 . . . . 25.0 116.828 -169.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.8 t -125.4 6.72 7.68 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.689 0.757 . . . . 25.0 109.315 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -107.72 158.45 33.35 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.7 -1.137 . . . . 25.0 108.416 -173.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -66.53 156.12 66.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 O-C-N 121.961 0.453 . . . . 25.0 111.812 178.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -70.33 100.1 1.67 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.123 0.487 . . . . 25.0 112.033 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.6 p -93.51 152.72 18.87 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.648 -1.241 . . . . 25.0 107.648 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -66.14 -25.19 66.86 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.745 -0.597 . . . . 25.0 111.073 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.29 65.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.306 -0.861 . . . . 25.0 112.235 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.5 t -82.02 -5.51 58.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.319 0.489 . . . . 25.0 112.319 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -103.87 154.24 19.84 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 114.673 1.36 . . . . 25.0 114.673 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -94.87 95.65 8.81 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 103.013 -2.958 . . . . 25.0 103.013 163.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.97 -7.03 19.29 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.109 1.152 . . . . 25.0 114.109 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.68 118.75 73.39 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.89 -0.781 . . . . 25.0 108.89 176.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.36 141.31 42.49 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 115.403 -2.598 . . . . 25.0 111.804 179.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -89.98 -12.97 37.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.523 0.564 . . . . 25.0 112.523 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.6 m -149.11 66.11 1.03 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.488 -0.324 . . . . 25.0 111.259 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -88.99 132.52 34.69 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.749 -1.181 . . . . 25.0 109.018 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -123.03 99.19 6.25 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.664 -2.347 . . . . 25.0 104.664 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -90.27 92.06 8.76 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.418 -1.327 . . . . 25.0 107.418 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -104.48 118.17 35.94 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.979 -1.489 . . . . 25.0 106.979 177.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.84 80.53 0.4 Allowed Glycine 0 CA--C 1.503 -0.696 0 CA-C-N 115.396 -0.82 . . . . 25.0 113.48 -170.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.47 15.18 6.03 Favored Glycine 0 C--N 1.322 -0.25 0 C-N-CA 120.916 -0.659 . . . . 25.0 113.661 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.48 104.82 5.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.563 0.697 . . . . 25.0 109.689 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.38 123.23 89.26 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 106.092 -1.818 . . . . 25.0 106.092 176.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.68 161.39 44.06 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 118.352 -0.632 . . . . 25.0 113.739 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.58 26.61 3.38 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.965 -1.124 . . . . 25.0 107.965 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.13 -15.45 0.41 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.975 1.71 . . . . 25.0 111.947 -174.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -129.43 151.01 50.53 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 103.776 -2.675 . . . . 25.0 103.776 169.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.46 95.0 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 122.382 1.087 . . . . 25.0 108.633 -178.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.8 m -87.36 124.72 33.69 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -118.4 162.44 18.32 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 105.27 -2.122 . . . . 25.0 105.27 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -133.95 146.35 50.4 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 103.81 -2.663 . . . . 25.0 103.81 171.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.22 158.81 27.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.986 -1.116 . . . . 25.0 107.986 -176.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -102.13 117.0 33.86 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.119 0.262 . . . . 25.0 110.67 -177.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.5 mt -75.31 132.13 76.72 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 107.238 -1.393 . . . . 25.0 107.238 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.89 145.93 96.7 Favored 'Trans proline' 0 C--N 1.352 0.742 0 CA-C-O 121.753 0.647 . . . . 25.0 113.492 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.445 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.11 -25.83 39.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.093 -0.958 . . . . 25.0 112.48 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -84.01 9.12 13.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.697 -0.683 . . . . 25.0 110.165 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -116.0 51.26 0.97 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.837 0.827 . . . . 25.0 108.966 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.9 p -86.11 165.2 16.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.868 -1.53 . . . . 25.0 106.868 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.29 -169.09 32.83 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 114.541 0.576 . . . . 25.0 114.541 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.0 114.36 22.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.433 0.635 . . . . 25.0 111.116 -168.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.96 170.46 21.3 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.725 -0.671 . . . . 25.0 110.657 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -105.85 150.61 8.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 107.406 -1.331 . . . . 25.0 107.406 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 50.1 mt -131.45 120.21 45.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.214 -2.143 . . . . 25.0 105.214 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.78 130.07 49.64 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.453 -0.794 . . . . 25.0 109.545 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -116.66 129.74 56.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.72 140.18 48.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.154 0.978 . . . . 25.0 112.028 -177.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -114.53 117.36 30.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 106.43 -1.693 . . . . 25.0 106.43 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.08 126.49 42.28 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.5 mm -81.79 141.62 14.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.453 -0.573 . . . . 25.0 109.453 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.58 -42.39 22.37 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.767 0.712 . . . . 25.0 110.394 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.09 -24.08 65.0 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.583 0.957 . . . . 25.0 113.583 -172.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.7 p -139.32 170.54 15.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.966 0.889 . . . . 25.0 110.21 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.22 23.64 0.58 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.125 -0.943 . . . . 25.0 112.21 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -94.32 147.48 23.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.691 -0.631 . . . . 25.0 112.606 -176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.19 143.24 12.08 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.053 -2.203 . . . . 25.0 105.053 172.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -146.66 136.03 22.82 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.997 0.74 . . . . 25.0 112.997 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -93.98 114.8 27.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.524 -0.762 . . . . 25.0 111.54 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -97.05 113.37 24.91 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.21 140.71 29.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.043 -0.526 . . . . 25.0 112.051 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.5 tt -125.13 135.47 63.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.787 -1.931 . . . . 25.0 105.787 167.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -95.31 131.2 41.67 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.766 -1.198 . . . . 25.0 107.766 176.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.5 m -132.76 163.23 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 113.103 0.779 . . . . 25.0 113.103 -175.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -119.53 95.04 4.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 104.386 -2.45 . . . . 25.0 104.386 167.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.3 tp -90.03 163.96 14.7 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 112.689 0.625 . . . . 25.0 112.689 -172.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.5 p -144.33 156.74 44.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.153 -1.054 . . . . 25.0 108.153 175.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.379 -0.82 . . . . 25.0 112.416 -175.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.7 m170 . . . . . 0 N--CA 1.484 1.237 0 CA-C-O 121.372 0.606 . . . . 25.0 110.761 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.26 168.76 34.14 Favored Glycine 0 N--CA 1.451 -0.32 1 N-CA-C 100.85 -4.9 . . . . 25.0 100.85 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -146.69 162.64 38.06 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 120.374 2.087 . . . . 25.0 110.507 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -99.34 122.6 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.979 -1.119 . . . . 25.0 107.979 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -73.42 -42.95 61.41 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.801 -1.09 . . . . 25.0 109.593 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -152.62 129.56 5.61 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 106.129 -1.804 . . . . 25.0 106.129 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.67 133.37 16.49 Favored 'Cis proline' 0 CA--C 1.534 0.495 0 C-N-CA 128.577 0.657 . . . . 25.0 111.476 -0.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.52 110.72 3.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 25.0 112.409 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 156.81 38.74 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.275 -0.639 . . . . 25.0 109.275 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -56.3 -24.77 45.54 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.642 0.777 . . . . 25.0 112.656 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.99 -49.89 58.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.771 0.796 . . . . 25.0 109.066 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -66.22 -37.43 85.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.468 -0.787 . . . . 25.0 109.888 177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -63.17 -33.1 74.73 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 122.258 -0.276 . . . . 25.0 110.808 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -39.07 91.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 25.0 110.235 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.447 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -67.67 -35.92 79.76 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.565 -0.531 . . . . 25.0 109.565 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.9 mt -77.37 4.09 11.65 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.21 -0.45 . . . . 25.0 111.599 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 58.19 22.44 9.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.306 1.443 . . . . 25.0 113.265 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.461 ' C ' HD22 ' A' ' 19' ' ' ASN . 93.1 mt -85.03 -21.09 29.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.242 -1.392 . . . . 25.0 107.242 173.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.461 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.04 158.16 32.81 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.2 p -136.77 175.34 9.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.112 -0.329 . . . . 25.0 110.112 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 72.11 4.91 5.17 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.423 1.638 . . . . 25.0 115.423 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -66.63 -38.26 86.55 Favored 'General case' 0 CA--C 1.501 -0.918 0 O-C-N 121.823 -0.548 . . . . 25.0 110.972 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -63.49 1.42 Allowed Glycine 0 C--O 1.218 -0.854 0 O-C-N 123.753 0.658 . . . . 25.0 112.271 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.9 t -87.81 -54.35 4.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.571 1.177 . . . . 25.0 111.37 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.445 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -68.83 -7.01 6.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.236 -1.347 . . . . 25.0 113.82 -171.686 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.437 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.9 pt20 -91.51 0.3 57.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.848 -0.533 . . . . 25.0 111.261 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -116.02 -34.08 4.85 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.904 -0.719 . . . . 25.0 109.893 173.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -126.91 101.75 25.83 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 109.284 -0.636 . . . . 25.0 109.284 169.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.447 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 98.0 Cg_endo -73.24 -20.4 21.37 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 117.108 -1.461 . . . . 25.0 114.53 -174.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -86.17 11.87 10.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.338 0.495 . . . . 25.0 112.338 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.1 m -65.18 -12.42 50.96 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.1 130.24 28.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 122.135 0.969 . . . . 25.0 112.919 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -152.96 151.07 29.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 104.975 -2.232 . . . . 25.0 104.975 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.65 -169.38 22.89 Favored Glycine 0 C--O 1.229 -0.216 0 N-CA-C 109.755 -1.338 . . . . 25.0 109.755 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.42 147.83 49.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 118.051 0.926 . . . . 25.0 111.725 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -65.99 157.04 31.87 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.883 -1.154 . . . . 25.0 107.883 172.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.58 -4.01 1.66 Allowed Glycine 0 C--N 1.317 -0.494 0 CA-C-N 114.773 -1.103 . . . . 25.0 112.91 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -75.76 144.58 76.9 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 121.689 -0.889 . . . . 25.0 109.116 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -91.54 -17.86 14.83 Favored 'Cis proline' 0 CA--C 1.543 0.962 0 N-CA-C 116.041 1.516 . . . . 25.0 116.041 -5.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.6 -37.44 62.88 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.913 1.449 . . . . 25.0 114.913 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -116.47 32.29 6.22 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.212 -1.773 . . . . 25.0 106.212 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.59 -176.94 47.0 Favored Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 114.591 -1.186 . . . . 25.0 110.744 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.95 171.54 3.68 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.982 2.455 . . . . 25.0 113.095 177.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.11 160.07 30.9 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.726 -1.213 . . . . 25.0 107.726 174.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.75 139.62 57.14 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 106.038 -1.838 . . . . 25.0 106.038 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 106' ' ' PRO . . . 86.4 -8.02 76.33 Favored Glycine 0 C--O 1.229 -0.163 0 CA-C-N 116.403 -0.362 . . . . 25.0 112.666 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -126.18 9.5 7.37 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.396 -0.473 . . . . 25.0 111.329 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.86 -49.53 83.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 122.151 -0.343 . . . . 25.0 111.166 -174.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -20.9 57.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.98 0.419 . . . . 25.0 110.266 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -84.73 -8.57 58.79 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.995 0.739 . . . . 25.0 112.995 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 33.31 13.65 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.53 0.732 . . . . 25.0 110.043 -172.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.47 39.24 25.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.816 1.414 . . . . 25.0 114.816 -177.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -120.55 137.55 54.33 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.105 0.562 . . . . 25.0 110.714 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.0 p -62.95 -36.28 82.95 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 115.617 1.71 . . . . 25.0 115.617 -173.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 t -72.29 -5.01 33.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -177.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.702 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -121.14 12.5 11.08 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -72.23 -36.5 69.12 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.051 -1.031 . . . . 25.0 110.106 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -71.69 -11.07 60.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.496 -0.774 . . . . 25.0 109.715 175.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.0 mp -93.95 -1.3 54.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.822 -0.807 . . . . 25.0 108.822 -177.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -116.26 -32.02 5.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.567 0.58 . . . . 25.0 112.567 174.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -92.22 131.77 37.19 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 107.453 -1.314 . . . . 25.0 107.453 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.476 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.3 pm0 -137.56 160.61 38.69 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.405 -0.816 . . . . 25.0 111.443 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 52.8 p -119.99 159.57 46.42 Favored Pre-proline 0 C--O 1.242 0.667 1 N-CA-C 100.068 -4.049 . . . . 25.0 100.068 159.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -70.32 -6.37 18.72 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 116.281 -2.012 . . . . 25.0 115.558 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.2 t -114.5 2.1 14.51 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.636 0.606 . . . . 25.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -78.33 -28.13 47.26 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.088 0.773 . . . . 25.0 113.088 -175.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.476 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.5 m95 -124.5 163.13 22.5 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 120.581 0.229 . . . . 25.0 110.608 -177.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.31 129.49 40.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 106.158 -1.793 . . . . 25.0 106.158 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -101.86 107.56 18.78 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 100.231 -3.989 . . . . 25.0 100.231 177.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -68.37 134.48 50.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.242 -0.89 . . . . 25.0 110.141 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -92.63 100.78 13.23 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 25.0 108.0 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.5 mt -131.17 173.99 10.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.106 -1.072 . . . . 25.0 108.106 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.23 154.33 25.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 111.519 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.445 HG22 HD23 ' A' ' 168' ' ' LEU . 58.9 p -77.04 168.37 20.2 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 96.61 -161.86 22.2 Favored Glycine 0 C--O 1.241 0.564 0 N-CA-C 110.366 -1.094 . . . . 25.0 110.366 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.95 132.29 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 CA-C-N 119.057 1.429 . . . . 25.0 113.482 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.94 160.76 38.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.473 -1.677 . . . . 25.0 106.473 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 p -101.37 151.1 22.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.686 -1.227 . . . . 25.0 107.686 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -138.02 100.97 4.3 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.074 -2.195 . . . . 25.0 105.074 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.07 114.33 28.15 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.356 -0.838 . . . . 25.0 110.038 -176.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -101.5 150.96 22.53 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.526 -0.761 . . . . 25.0 110.631 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -126.63 116.46 21.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 104.092 -2.559 . . . . 25.0 104.092 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.76 126.64 55.64 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.547 -0.751 . . . . 25.0 110.952 -174.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.3 t -89.01 13.9 11.85 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.44 0.638 . . . . 25.0 110.565 176.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -133.68 138.75 46.03 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.94 -0.475 . . . . 25.0 109.855 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -86.09 -7.67 58.43 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.681 0.623 . . . . 25.0 112.681 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.77 157.92 31.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.4 t -76.98 156.0 32.22 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 114.809 1.411 . . . . 25.0 114.809 -172.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -97.14 159.41 14.93 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 172.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -117.81 -14.54 10.11 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 123.127 0.267 . . . . 25.0 111.263 171.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -172.19 152.85 2.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.947 0.403 . . . . 25.0 111.335 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -125.43 136.91 53.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 167.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -142.04 150.19 40.94 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.044 -1.095 . . . . 25.0 108.044 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -136.57 133.6 36.56 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.03 164.14 35.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.334 0.515 . . . . 25.0 110.595 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.91 164.81 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.331 0.863 . . . . 25.0 113.331 -166.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.6 p -81.33 162.92 23.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.286 -1.375 . . . . 25.0 107.286 168.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -61.27 157.71 42.21 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.468 -0.787 . . . . 25.0 108.996 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -69.0 -22.33 35.75 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 116.464 -1.891 . . . . 25.0 114.021 -173.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -114.05 31.9 6.24 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.322 0.49 . . . . 25.0 112.322 -173.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.506 ' HE1' ' HA ' ' A' ' 145' ' ' HIS . 5.5 p-90 -80.42 163.31 23.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.527 0.68 . . . . 25.0 110.106 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -87.28 101.08 13.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.309 -0.86 . . . . 25.0 110.324 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.19 22.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 115.253 1.575 . . . . 25.0 115.253 -174.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.1 t -118.93 1.09 11.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.565 0.697 . . . . 25.0 109.852 175.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -112.51 160.0 32.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 107.937 -1.135 . . . . 25.0 107.937 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . 0.417 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 58.1 Cg_endo -64.36 159.48 43.67 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 120.431 0.754 . . . . 25.0 112.592 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.4 mp -68.12 117.12 9.54 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 122.189 -0.32 . . . . 25.0 110.293 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.5 p -114.41 150.59 34.45 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.578 -0.897 . . . . 25.0 108.578 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.8 ptp180 -64.57 -24.9 67.75 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.977 -0.452 . . . . 25.0 111.621 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.54 72.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.699 -0.682 . . . . 25.0 111.999 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 85.0 p -88.98 -3.01 58.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.111 -0.495 . . . . 25.0 111.978 -178.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -97.28 150.81 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.941 1.46 . . . . 25.0 114.941 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.23 96.15 8.22 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 102.883 -3.006 . . . . 25.0 102.883 162.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.26 0.63 7.52 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.142 1.164 . . . . 25.0 114.142 -171.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 10.2 t -98.19 134.46 22.01 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.197 -0.668 . . . . 25.0 109.197 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 146.81 37.99 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 116.447 -1.902 . . . . 25.0 112.29 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -97.1 -6.63 34.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.995 0.426 . . . . 25.0 111.335 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 36.0 m -151.71 71.61 0.99 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -88.88 131.35 35.15 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 119.172 -1.011 . . . . 25.0 109.628 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -122.03 99.06 6.23 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 103.465 -2.791 . . . . 25.0 103.465 176.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -92.8 91.95 7.71 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.433 -1.321 . . . . 25.0 107.433 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -113.74 118.56 34.66 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.81 81.8 0.36 Allowed Glycine 0 CA--C 1.501 -0.841 0 CA-C-N 115.551 -0.749 . . . . 25.0 112.901 -170.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.47 16.06 5.24 Favored Glycine 0 C--N 1.32 -0.342 0 C-N-CA 120.931 -0.652 . . . . 25.0 113.699 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.88 104.03 4.61 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.579 0.704 . . . . 25.0 109.449 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.7 126.23 90.82 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 106.376 -1.712 . . . . 25.0 106.376 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.09 171.13 18.91 Favored 'Trans proline' 0 C--N 1.344 0.294 0 N-CA-C 113.573 0.566 . . . . 25.0 113.573 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.438 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.55 29.84 5.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.687 -1.227 . . . . 25.0 107.687 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.08 -15.04 0.35 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.894 1.678 . . . . 25.0 111.868 -173.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.438 ' H ' ' C ' ' A' ' 128' ' ' ALA . 68.4 mt-30 -129.0 154.69 46.37 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 103.416 -2.809 . . . . 25.0 103.416 170.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.4 t -140.48 94.98 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.577 0 N-CA-C 106.266 -1.753 . . . . 25.0 106.266 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.14 145.57 27.56 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 104.43 -2.433 . . . . 25.0 104.43 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.04 166.98 31.8 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.493 -1.685 . . . . 25.0 108.217 -178.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -136.14 154.3 51.02 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.95 160.55 30.92 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.769 -1.567 . . . . 25.0 106.769 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -103.38 115.55 30.76 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.018 0.199 . . . . 25.0 111.004 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.71 130.33 73.89 Favored Pre-proline 0 C--O 1.239 0.519 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.69 147.22 95.02 Favored 'Trans proline' 0 C--N 1.351 0.683 0 CA-C-O 121.729 0.637 . . . . 25.0 113.232 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.95 -24.22 38.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.188 -0.915 . . . . 25.0 112.554 -169.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.4 p-10 -85.02 9.57 14.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.65 -0.705 . . . . 25.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -113.51 56.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.864 -1.161 . . . . 25.0 107.864 170.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.2 p -86.18 170.79 11.83 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 106.968 -1.493 . . . . 25.0 106.968 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 82.25 -165.42 44.94 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 116.926 1.53 . . . . 25.0 116.926 174.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.4 t -86.04 106.47 17.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.295 0.569 . . . . 25.0 110.962 -168.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.506 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.6 p-80 -157.96 172.43 18.46 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.082 -0.508 . . . . 25.0 111.306 -176.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.8 p -102.87 150.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.786 -1.19 . . . . 25.0 107.786 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.9 mt -134.84 129.6 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 N-CA-C 101.487 -3.523 . . . . 25.0 101.487 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -120.28 139.71 52.31 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 109.78 -0.452 . . . . 25.0 109.78 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -120.6 134.26 55.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.073 -0.714 . . . . 25.0 109.073 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.25 139.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 122.165 0.983 . . . . 25.0 112.02 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -109.45 113.2 25.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.299 -1.741 . . . . 25.0 106.299 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 122.22 35.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.735 -1.209 . . . . 25.0 107.735 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.8 mm -78.52 142.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.388 -0.597 . . . . 25.0 109.388 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.23 -43.19 24.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.819 0.736 . . . . 25.0 110.224 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.01 -23.47 65.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.755 -1.111 . . . . 25.0 113.898 -172.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.0 p -139.82 170.4 15.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.045 0.926 . . . . 25.0 110.299 -175.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.6 20.04 0.96 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.115 -0.948 . . . . 25.0 112.232 177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.13 146.07 24.57 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.617 -0.677 . . . . 25.0 112.491 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.41 143.46 11.87 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.385 -2.08 . . . . 25.0 105.385 172.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -146.6 130.9 17.53 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 111.772 0.286 . . . . 25.0 111.772 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -88.95 115.76 26.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.868 -0.605 . . . . 25.0 110.663 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.02 20.67 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.691 -0.855 . . . . 25.0 108.691 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.68 143.43 33.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 25.0 112.552 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -129.0 134.94 63.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 105.135 -2.172 . . . . 25.0 105.135 166.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -94.45 130.93 40.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.84 162.26 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 112.973 0.731 . . . . 25.0 112.973 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -120.38 95.12 4.6 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.362 -2.459 . . . . 25.0 104.362 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.445 HD23 HG22 ' A' ' 74' ' ' THR . 1.9 tp -90.5 162.81 14.88 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 113.274 0.842 . . . . 25.0 113.274 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.3 p -145.26 164.42 31.46 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.72 0 CA-C-O 117.966 -1.016 . . . . 25.0 110.785 -178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.2 m80 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.328 0.585 . . . . 25.0 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.59 169.79 38.38 Favored Glycine 0 CA--C 1.508 -0.357 1 N-CA-C 102.54 -4.224 . . . . 25.0 102.54 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 p90 -144.16 160.01 41.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 119.954 1.877 . . . . 25.0 110.461 178.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.24 121.14 47.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.48 -40.94 56.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.515 -1.22 . . . . 25.0 109.972 -174.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.6 t -153.7 128.68 4.88 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 105.77 -1.937 . . . . 25.0 105.77 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.19 130.6 11.28 Favored 'Cis proline' 0 C--N 1.348 0.512 0 C-N-CA 128.554 0.648 . . . . 25.0 111.099 -0.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 114.48 5.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.106 -0.497 . . . . 25.0 112.263 -172.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.1 t -71.86 158.64 35.69 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 108.628 -0.878 . . . . 25.0 108.628 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -54.6 -26.33 31.93 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.578 0.751 . . . . 25.0 111.81 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.97 -53.45 38.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.678 0.752 . . . . 25.0 109.327 175.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.09 -34.86 78.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.733 -0.667 . . . . 25.0 110.558 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -63.45 -33.14 74.9 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 122.174 -0.329 . . . . 25.0 110.548 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -40.03 95.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.319 0.581 . . . . 25.0 109.617 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.422 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -68.3 -33.85 75.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.081 -0.509 . . . . 25.0 110.395 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.91 5.21 14.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.454 176.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 58.83 23.23 11.05 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.098 1.359 . . . . 25.0 113.053 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.484 ' C ' HD22 ' A' ' 19' ' ' ASN . 90.4 mt -88.44 -21.24 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.818 -1.178 . . . . 25.0 107.818 174.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.484 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.31 160.17 28.65 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.687 -2.338 . . . . 25.0 104.687 176.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -136.42 174.8 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.247 -0.279 . . . . 25.0 110.247 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 71.8 5.26 5.31 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.917 1.821 . . . . 25.0 115.917 173.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.3 m -67.35 -35.2 78.89 Favored 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 121.555 -0.716 . . . . 25.0 111.045 174.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.4 -64.3 1.38 Allowed Glycine 0 C--O 1.217 -0.918 0 O-C-N 123.818 0.699 . . . . 25.0 112.185 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 t -87.89 -54.09 4.42 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.621 1.2 . . . . 25.0 111.176 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.444 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.73 -8.27 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.151 -1.386 . . . . 25.0 113.164 -171.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.81 1.75 54.73 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.976 -0.453 . . . . 25.0 111.505 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.51 -34.88 3.68 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.713 -0.795 . . . . 25.0 110.427 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -127.12 100.57 26.77 Favored Pre-proline 0 C--O 1.241 0.636 0 C-N-CA 122.132 0.173 . . . . 25.0 111.163 169.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.422 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.2 Cg_endo -74.05 -21.28 18.36 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 117.141 -1.439 . . . . 25.0 114.505 -176.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -83.83 11.98 6.75 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.697 0.629 . . . . 25.0 112.697 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -68.99 -16.22 63.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.739 0.304 . . . . 25.0 111.77 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.68 137.69 24.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 113.983 1.105 . . . . 25.0 113.983 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -152.97 152.99 32.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 106.156 -1.794 . . . . 25.0 106.156 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -155.34 -168.31 18.27 Favored Glycine 0 C--O 1.229 -0.206 0 N-CA-C 108.694 -1.763 . . . . 25.0 108.694 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.6 tp -127.8 147.31 50.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 118.325 1.063 . . . . 25.0 111.704 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -66.47 156.89 33.52 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 172.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 1.84 3.84 Favored Glycine 0 C--O 1.225 -0.43 0 CA-C-N 114.962 -1.017 . . . . 25.0 113.255 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.95 145.1 77.05 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 121.732 -0.864 . . . . 25.0 109.691 -176.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -91.63 -16.07 18.36 Favored 'Cis proline' 0 CA--C 1.54 0.823 0 N-CA-C 115.119 1.161 . . . . 25.0 115.119 -6.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -71.8 -35.68 70.06 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.711 1.374 . . . . 25.0 114.711 -169.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.43 30.97 6.99 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.508 -2.034 . . . . 25.0 105.508 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.31 -173.43 40.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 114.259 -1.337 . . . . 25.0 111.131 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.11 171.61 4.91 Favored 'Trans proline' 0 C--O 1.242 0.685 0 C-N-CA 123.099 2.532 . . . . 25.0 113.713 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.01 159.94 31.15 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.649 -1.612 . . . . 25.0 106.649 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.42 138.81 58.27 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.385 -1.28 . . . . 25.0 107.864 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.83 -4.32 82.89 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-O 121.408 0.449 . . . . 25.0 112.794 -174.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -124.19 10.23 8.69 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.171 -0.678 . . . . 25.0 109.171 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.0 mt -65.32 -50.16 74.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 122.361 -0.212 . . . . 25.0 111.509 -173.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.64 -20.35 58.56 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.811 -0.556 . . . . 25.0 110.124 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.0 p -83.54 -8.27 59.37 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.434 0.531 . . . . 25.0 112.434 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.42 34.02 14.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.627 0.771 . . . . 25.0 110.168 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.07 39.74 25.96 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.734 1.383 . . . . 25.0 114.734 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -120.74 134.4 55.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.174 0.59 . . . . 25.0 110.752 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -62.38 -34.34 76.51 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.698 1.37 . . . . 25.0 114.698 -175.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 t -70.49 -8.33 50.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.488 0.551 . . . . 25.0 112.488 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.693 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -120.84 13.76 11.53 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.479 -1.304 . . . . 25.0 107.479 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -72.4 -37.18 68.75 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.056 -1.028 . . . . 25.0 110.455 -176.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -71.45 -13.7 61.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.721 0.772 . . . . 25.0 109.084 174.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.693 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.3 mp -90.17 -3.78 57.66 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.673 -0.694 . . . . 25.0 109.142 -178.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -113.95 -34.21 5.5 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -92.82 119.91 32.64 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 121.596 -0.69 . . . . 25.0 110.312 -178.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.484 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.14 160.96 25.38 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.213 -0.903 . . . . 25.0 108.888 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.8 p -117.77 162.67 27.88 Favored Pre-proline 0 C--N 1.316 -0.857 1 N-CA-C 99.671 -4.196 . . . . 25.0 99.671 162.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.84 -4.91 14.29 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 116.782 -1.679 . . . . 25.0 115.687 -175.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -125.54 11.53 7.97 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.228 0.537 . . . . 25.0 111.783 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -77.46 -28.21 52.33 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.868 0.692 . . . . 25.0 112.868 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.484 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.5 m95 -125.88 165.41 18.78 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 110.145 -0.317 . . . . 25.0 110.145 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -66.87 126.54 29.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.23 -2.137 . . . . 25.0 105.23 168.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -94.86 104.89 16.79 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 100.294 -3.965 . . . . 25.0 100.294 177.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.79 134.87 54.03 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.654 -1.157 . . . . 25.0 110.098 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -93.26 99.37 11.93 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.585 -1.265 . . . . 25.0 107.585 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.9 mt -129.68 173.83 10.26 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.669 -1.975 . . . . 25.0 105.669 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -116.73 163.35 16.27 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -178.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.437 HG22 HD23 ' A' ' 168' ' ' LEU . 73.8 p -77.48 172.88 12.65 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.653 -1.612 . . . . 25.0 107.086 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.54 -162.62 31.94 Favored Glycine 0 C--O 1.24 0.479 0 N-CA-C 111.125 -0.79 . . . . 25.0 111.125 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.13 130.25 35.44 Favored 'Trans proline' 0 C--N 1.346 0.418 0 CA-C-N 118.8 1.3 . . . . 25.0 113.667 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -137.52 158.59 44.06 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.51 -1.663 . . . . 25.0 106.51 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 p -96.22 150.31 20.68 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -135.3 100.94 4.67 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 104.512 -2.403 . . . . 25.0 104.512 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.72 114.64 28.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.911 0.862 . . . . 25.0 109.521 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -100.08 146.99 26.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.3 -0.864 . . . . 25.0 109.492 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.31 114.39 18.19 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 103.624 -2.732 . . . . 25.0 103.624 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.8 mp -111.93 133.15 54.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.596 -0.729 . . . . 25.0 110.83 -172.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -99.19 17.85 18.92 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.763 0.792 . . . . 25.0 109.049 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.58 133.74 50.99 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.201 -0.666 . . . . 25.0 109.201 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -87.27 -17.21 33.06 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.535 0.939 . . . . 25.0 113.535 -177.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -73.1 162.05 29.91 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.956 0.724 . . . . 25.0 112.956 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -66.41 155.93 36.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 116.508 2.04 . . . . 25.0 116.508 -170.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 8.2 t -101.37 158.98 15.66 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.694 -1.225 . . . . 25.0 107.694 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -117.94 -17.22 9.79 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.302 0.482 . . . . 25.0 112.302 172.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.9 t -171.09 154.38 4.06 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.503 0.556 . . . . 25.0 112.503 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.8 m95 -128.8 140.71 51.58 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 104.64 -2.355 . . . . 25.0 104.64 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.6 mtt-85 -147.43 151.7 36.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.39 -0.967 . . . . 25.0 108.39 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -137.93 138.72 39.27 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.114 -1.439 . . . . 25.0 107.114 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.66 162.77 39.56 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.284 0.493 . . . . 25.0 109.92 176.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.99 164.96 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 114.275 1.213 . . . . 25.0 114.275 -167.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 11.0 p -79.6 161.65 25.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.226 -1.027 . . . . 25.0 108.226 169.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.65 157.47 47.7 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.116 -0.947 . . . . 25.0 109.621 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.77 -18.44 36.96 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 117.444 -1.237 . . . . 25.0 114.072 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.73 31.93 6.21 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 122.791 0.436 . . . . 25.0 111.566 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -74.25 162.88 28.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.847 0.832 . . . . 25.0 111.434 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -83.64 101.06 11.24 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.736 -1.12 . . . . 25.0 110.172 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -84.81 14.09 5.16 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 116.597 2.073 . . . . 25.0 116.597 -171.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -117.93 1.91 12.1 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.833 -0.802 . . . . 25.0 108.833 175.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -105.09 158.48 32.0 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 107.832 -1.173 . . . . 25.0 107.832 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -66.65 159.44 51.0 Favored 'Trans proline' 0 C--N 1.344 0.327 0 O-C-N 122.024 0.486 . . . . 25.0 112.232 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.96 101.9 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 25.0 110.641 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.6 p -98.63 159.76 14.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.449 -0.945 . . . . 25.0 108.449 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -65.42 -25.76 67.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.097 0.475 . . . . 25.0 110.964 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -24.97 61.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.648 -0.706 . . . . 25.0 112.277 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.7 m -79.29 -12.1 59.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.754 0.311 . . . . 25.0 111.82 -178.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 42.2 m-85 -99.17 155.04 17.68 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.16 1.541 . . . . 25.0 115.16 -174.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -94.43 95.63 8.98 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 102.619 -3.104 . . . . 25.0 102.619 163.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.9 mt -69.79 20.89 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 116.428 2.011 . . . . 25.0 116.428 -169.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.0 t -114.3 137.39 22.52 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.272 -0.64 . . . . 25.0 109.272 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.77 152.07 46.91 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.208 -2.728 . . . . 25.0 111.196 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -107.9 -6.69 16.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.972 0.415 . . . . 25.0 111.688 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.5 m -152.6 70.06 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.133 -0.485 . . . . 25.0 109.911 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -89.06 135.06 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.239 -0.984 . . . . 25.0 109.172 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.01 99.12 5.98 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.765 -2.309 . . . . 25.0 104.765 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -93.24 92.06 7.55 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.931 -0.766 . . . . 25.0 108.931 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -107.42 117.06 33.1 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.671 -1.233 . . . . 25.0 107.671 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.55 80.58 0.37 Allowed Glycine 0 CA--C 1.503 -0.703 0 CA-C-N 115.799 -0.637 . . . . 25.0 113.519 -170.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.43 15.87 5.8 Favored Glycine 0 C--N 1.322 -0.237 0 C-N-CA 120.96 -0.638 . . . . 25.0 113.264 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.48 105.59 4.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.358 0.599 . . . . 25.0 109.585 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 88.8 mt -72.29 122.59 87.83 Favored Pre-proline 0 C--N 1.321 -0.673 0 N-CA-C 105.384 -2.08 . . . . 25.0 105.384 175.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.94 167.24 26.55 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 117.864 -0.957 . . . . 25.0 113.826 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.4 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -96.32 25.8 4.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.291 -1.003 . . . . 25.0 108.291 175.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.65 -12.36 0.46 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.822 1.649 . . . . 25.0 112.168 -174.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 128' ' ' ALA . 63.7 mt-30 -130.12 152.2 49.83 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.046 -2.576 . . . . 25.0 104.046 169.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.1 t -142.94 95.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.843 -1.54 . . . . 25.0 106.843 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -86.94 141.09 28.97 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.199 -2.148 . . . . 25.0 105.199 174.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.52 167.0 26.53 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.513 -2.032 . . . . 25.0 105.513 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -134.08 152.02 51.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.04 -2.208 . . . . 25.0 105.04 172.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.3 160.33 35.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.441 -1.318 . . . . 25.0 107.441 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -103.43 116.0 31.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.597 -0.274 . . . . 25.0 111.018 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 131.24 72.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -60.91 144.21 99.52 Favored 'Trans proline' 0 C--N 1.352 0.726 0 N-CA-C 113.919 0.7 . . . . 25.0 113.919 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.23 -28.2 42.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.182 -0.917 . . . . 25.0 112.514 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -82.35 10.25 7.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.733 0.778 . . . . 25.0 110.133 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -117.78 53.43 0.94 Allowed 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.553 -1.277 . . . . 25.0 107.553 171.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.95 11.82 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 106.398 -1.704 . . . . 25.0 106.398 174.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.95 -165.15 41.47 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 116.262 1.265 . . . . 25.0 116.262 176.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -86.02 108.61 18.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.446 0.641 . . . . 25.0 111.012 -168.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.408 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 44.0 p-80 -159.39 172.36 18.07 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.784 -0.644 . . . . 25.0 110.921 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -109.06 152.04 11.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.219 -1.03 . . . . 25.0 108.219 -179.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 67.8 mt -134.44 123.22 42.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 104.229 -2.508 . . . . 25.0 104.229 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.54 127.7 52.33 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 122.899 0.479 . . . . 25.0 110.261 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -111.54 129.36 56.08 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 108.816 -0.809 . . . . 25.0 108.816 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.7 p -126.72 139.75 50.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 122.172 0.987 . . . . 25.0 111.92 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 9.7 t90 -117.13 124.12 48.4 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.56 126.52 49.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.597 -0.52 . . . . 25.0 109.597 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 35.9 mm -77.85 142.47 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.93 -45.55 20.25 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.929 0.786 . . . . 25.0 110.678 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.17 -21.25 64.9 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.575 1.324 . . . . 25.0 114.575 -172.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 50.0 p -138.59 169.09 18.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.915 0.864 . . . . 25.0 109.577 -175.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.7 19.67 0.81 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.257 -0.883 . . . . 25.0 112.244 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.1 142.65 27.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -176.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.46 141.1 14.46 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 171.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -140.81 135.41 31.4 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.501 0.556 . . . . 25.0 112.501 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -93.65 112.47 24.35 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.449 -0.796 . . . . 25.0 111.149 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -97.15 108.21 20.89 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.971 -0.752 . . . . 25.0 108.971 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.11 141.75 33.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.744 -0.662 . . . . 25.0 111.737 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -125.27 132.88 70.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 105.553 -2.017 . . . . 25.0 105.553 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -96.46 129.42 43.83 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.3 162.31 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.666 0.987 . . . . 25.0 113.666 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.49 94.93 4.73 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.652 -2.721 . . . . 25.0 103.652 164.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.437 HD23 HG22 ' A' ' 74' ' ' THR . 2.9 tp -91.29 156.86 17.49 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 112.844 0.683 . . . . 25.0 112.844 -170.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.4 p -145.76 168.06 21.65 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.998 -0.439 . . . . 25.0 110.886 175.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.767 0 CA-C-O 118.711 -0.661 . . . . 25.0 110.602 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 121.012 0.434 . . . . 25.0 110.548 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.92 169.4 33.9 Favored Glycine 0 CA--C 1.509 -0.327 1 N-CA-C 101.872 -4.491 . . . . 25.0 101.872 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -145.75 161.49 39.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 120.188 1.994 . . . . 25.0 110.278 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -97.99 122.96 50.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.809 -1.182 . . . . 25.0 107.809 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -73.19 -43.34 61.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.999 -1.001 . . . . 25.0 109.424 -176.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.7 t -153.29 131.36 6.33 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.16 -1.793 . . . . 25.0 106.16 177.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.96 134.18 19.1 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.498 0.624 . . . . 25.0 111.395 -0.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.26 109.83 2.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.001 -0.545 . . . . 25.0 112.239 -172.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.6 t -71.94 157.55 37.63 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.947 -0.76 . . . . 25.0 108.947 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -55.86 -24.36 36.34 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.439 0.695 . . . . 25.0 111.812 178.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.54 -53.28 36.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.711 0.767 . . . . 25.0 109.279 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.01 -37.18 85.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.489 -0.778 . . . . 25.0 110.277 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -62.97 -32.82 74.23 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 120.991 -0.284 . . . . 25.0 110.814 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.05 94.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.086 0.47 . . . . 25.0 110.53 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.468 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.0 tmtm? -70.07 -33.42 71.9 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.05 0.452 . . . . 25.0 110.047 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.65 3.62 11.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.481 174.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.03 10.09 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.39 1.476 . . . . 25.0 113.05 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.439 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.8 mt -85.86 -22.28 27.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.196 -1.409 . . . . 25.0 107.196 173.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.439 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.5 m120 -123.3 158.78 30.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 105.004 -2.221 . . . . 25.0 105.004 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.6 p -135.95 177.76 7.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.463 -0.569 . . . . 25.0 109.463 -176.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 72.02 4.97 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.498 1.666 . . . . 25.0 115.498 173.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.4 m -69.95 -37.15 75.76 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.484 -0.76 . . . . 25.0 111.647 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.22 -63.5 1.72 Allowed Glycine 0 C--O 1.219 -0.838 0 O-C-N 123.474 0.484 . . . . 25.0 112.192 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.0 t -88.04 -53.33 4.78 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.392 1.092 . . . . 25.0 111.544 -178.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.9 OUTLIER -68.4 -10.56 13.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.447 -1.251 . . . . 25.0 113.054 -171.723 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -87.71 2.28 51.54 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.902 -0.499 . . . . 25.0 112.101 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -120.07 -34.74 3.62 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.756 -0.778 . . . . 25.0 110.677 172.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.05 105.32 22.32 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.288 -0.634 . . . . 25.0 109.288 169.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.468 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 86.9 Cg_endo -76.1 -20.23 14.93 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 116.326 -1.983 . . . . 25.0 114.16 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -85.0 12.11 8.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.555 0.576 . . . . 25.0 112.555 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -68.79 -12.13 61.15 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.859 0.361 . . . . 25.0 111.966 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.09 133.65 29.52 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.877 0.846 . . . . 25.0 112.734 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -152.85 153.93 34.08 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.882 -1.525 . . . . 25.0 106.882 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.53 -172.43 26.69 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 109.339 -1.504 . . . . 25.0 109.339 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.4 tp -124.28 151.49 44.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.848 0.824 . . . . 25.0 111.774 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -64.26 156.99 27.15 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.772 -1.196 . . . . 25.0 107.772 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.17 -2.68 3.25 Favored Glycine 0 C--O 1.223 -0.565 0 CA-C-N 114.517 -1.22 . . . . 25.0 113.028 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -75.76 138.89 69.89 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 121.407 -1.054 . . . . 25.0 110.522 -175.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -92.71 -15.76 16.73 Favored 'Cis proline' 0 CA--C 1.543 0.955 0 N-CA-C 115.609 1.35 . . . . 25.0 115.609 -6.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -71.05 -35.35 71.92 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.412 1.634 . . . . 25.0 115.412 -168.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.07 32.74 5.71 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.938 -1.875 . . . . 25.0 105.938 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.21 -174.28 40.57 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 114.407 -1.27 . . . . 25.0 111.496 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.98 170.87 4.28 Favored 'Trans proline' 0 C--O 1.241 0.637 0 C-N-CA 123.212 2.608 . . . . 25.0 113.359 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.13 159.96 31.03 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.2 -1.407 . . . . 25.0 107.2 174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.86 139.19 58.04 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.424 -1.262 . . . . 25.0 107.96 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.39 -5.66 76.34 Favored Glycine 0 C--O 1.23 -0.12 0 CA-C-O 121.704 0.613 . . . . 25.0 112.874 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 20.3 m170 -126.43 9.21 7.18 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 71.4 mt -65.96 -49.7 74.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.276 -0.265 . . . . 25.0 111.161 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.17 -21.26 58.89 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.842 -0.536 . . . . 25.0 109.774 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -83.4 -6.58 59.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.758 0.651 . . . . 25.0 112.758 -178.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.78 32.6 12.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.544 0.738 . . . . 25.0 110.209 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.45 35.78 22.97 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.636 1.347 . . . . 25.0 114.636 -177.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -120.56 141.19 50.51 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.999 0.52 . . . . 25.0 111.743 176.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -65.35 -35.27 80.47 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.0 -6.85 45.13 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.348 0.594 . . . . 25.0 112.353 -177.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.675 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -120.45 12.66 11.66 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 107.226 -1.398 . . . . 25.0 107.226 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -71.77 -36.02 70.23 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.893 -1.129 . . . . 25.0 110.112 -175.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -71.38 -14.47 62.18 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.834 0.826 . . . . 25.0 109.967 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.675 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.9 mp -87.48 -7.59 57.44 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.405 -0.961 . . . . 25.0 108.405 -178.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -112.35 -31.99 6.65 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 120.959 0.409 . . . . 25.0 112.006 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -94.94 122.1 37.23 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 121.66 -0.65 . . . . 25.0 109.898 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.439 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -130.0 160.97 32.02 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.423 -0.955 . . . . 25.0 108.423 177.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.4 p -117.05 163.6 22.32 Favored Pre-proline 0 C--N 1.32 -0.71 1 N-CA-C 99.778 -4.156 . . . . 25.0 99.778 162.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -2.29 9.46 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 116.473 -1.885 . . . . 25.0 115.936 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.4 t -128.03 11.1 6.5 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.512 0.673 . . . . 25.0 111.831 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -79.12 -29.19 43.05 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.179 -0.951 . . . . 25.0 113.549 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.439 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.2 m95 -125.71 166.88 15.97 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.957 -0.386 . . . . 25.0 109.957 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -66.55 118.58 10.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.842 -1.54 . . . . 25.0 106.842 172.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -92.4 103.65 16.06 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 100.624 -3.843 . . . . 25.0 100.624 176.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.18 135.03 53.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.8 -1.091 . . . . 25.0 110.195 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -92.88 99.96 12.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.562 -1.199 . . . . 25.0 107.799 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.8 mt -131.7 173.95 10.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.558 -1.645 . . . . 25.0 106.558 -175.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -114.79 163.22 15.81 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.929 1.085 . . . . 25.0 113.929 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.431 HG21 ' HA ' ' A' ' 139' ' ' ALA . 74.5 p -76.96 168.58 19.86 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.71 -161.14 24.7 Favored Glycine 0 C--O 1.24 0.514 0 N-CA-C 110.619 -0.993 . . . . 25.0 110.619 -178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.85 131.11 41.87 Favored 'Trans proline' 0 C--N 1.346 0.443 0 CA-C-N 119.1 1.45 . . . . 25.0 114.437 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -140.07 159.71 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.816 -1.55 . . . . 25.0 106.816 178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 p -105.84 150.9 25.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.751 -1.204 . . . . 25.0 107.751 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -137.34 100.89 4.37 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 105.083 -2.191 . . . . 25.0 105.083 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.03 116.83 32.73 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.909 0.862 . . . . 25.0 109.811 -176.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -103.26 150.54 23.63 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.635 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -127.76 115.41 18.64 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 103.964 -2.606 . . . . 25.0 103.964 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -116.04 124.38 50.31 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.009 0.744 . . . . 25.0 113.009 -172.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.1 t -88.23 -1.93 58.3 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.05 0.452 . . . . 25.0 110.59 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.16 119.97 37.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.4 mmm180 -84.3 -0.13 51.28 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.925 1.454 . . . . 25.0 114.925 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.13 155.39 39.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 117.741 0.246 . . . . 25.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.6 t -74.14 155.95 37.87 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 114.879 1.437 . . . . 25.0 114.879 -171.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 7.3 t -90.73 162.61 14.82 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.01 -0.995 . . . . 25.0 108.552 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -117.89 -14.52 10.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.922 -0.769 . . . . 25.0 108.922 168.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 t -175.2 154.41 1.75 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.006 0.431 . . . . 25.0 111.213 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.1 m95 -116.99 130.65 56.83 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.861 -2.644 . . . . 25.0 103.861 165.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 53.0 mtt-85 -133.59 147.46 51.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.953 -1.128 . . . . 25.0 107.953 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -137.37 132.24 33.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 106.627 -1.62 . . . . 25.0 106.627 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.99 164.86 33.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.368 0.531 . . . . 25.0 110.69 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 167.99 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 113.249 0.833 . . . . 25.0 113.249 -167.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.3 p -83.76 161.5 20.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.879 -1.156 . . . . 25.0 107.879 168.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -61.88 158.19 44.92 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.159 -0.928 . . . . 25.0 109.796 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.79 -18.34 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 117.557 -1.162 . . . . 25.0 114.739 -173.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -120.84 31.71 6.29 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.166 0.432 . . . . 25.0 112.166 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -76.34 165.17 25.23 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.653 0.74 . . . . 25.0 110.889 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -87.54 101.02 13.22 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.167 -0.924 . . . . 25.0 110.272 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -79.09 18.54 0.64 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 115.749 1.759 . . . . 25.0 115.749 -174.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -117.77 -2.46 11.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.328 -0.619 . . . . 25.0 109.328 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -101.67 157.4 33.75 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.367 -0.833 . . . . 25.0 108.91 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -66.63 157.66 59.77 Favored 'Trans proline' 0 C--N 1.346 0.441 0 O-C-N 121.94 0.442 . . . . 25.0 112.233 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.64 105.45 4.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.507 0.67 . . . . 25.0 111.174 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 68.3 p -99.34 157.07 16.66 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.008 -0.738 . . . . 25.0 109.008 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -65.95 -26.13 67.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.139 0.495 . . . . 25.0 110.873 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.96 -24.99 60.86 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.506 -0.77 . . . . 25.0 112.239 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.1 t -83.44 -11.1 57.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.985 0.421 . . . . 25.0 111.54 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -94.18 156.71 16.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.715 1.006 . . . . 25.0 113.715 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -97.21 96.12 8.21 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 102.826 -3.027 . . . . 25.0 102.826 162.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.37 -7.54 32.24 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.711 1.004 . . . . 25.0 113.711 -171.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.76 122.7 78.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 108.124 -1.065 . . . . 25.0 108.124 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.91 139.79 36.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.362 -2.625 . . . . 25.0 111.996 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -87.7 -15.56 36.77 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.392 0.516 . . . . 25.0 112.392 -175.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.5 m -149.31 66.68 1.02 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.427 -0.351 . . . . 25.0 110.668 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -89.09 139.23 30.68 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 118.426 -1.31 . . . . 25.0 109.336 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -118.19 100.93 7.84 Favored 'General case' 0 CA--C 1.496 -1.113 0 N-CA-C 101.225 -3.62 . . . . 25.0 101.225 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -88.56 92.12 9.07 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 105.571 -2.011 . . . . 25.0 105.571 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.83 117.64 33.36 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.736 -1.579 . . . . 25.0 106.736 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.97 81.12 0.51 Allowed Glycine 0 CA--C 1.5 -0.855 0 CA-C-N 115.441 -0.8 . . . . 25.0 111.798 -173.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.21 16.85 5.54 Favored Glycine 0 C--N 1.32 -0.33 0 C-N-CA 120.86 -0.686 . . . . 25.0 114.283 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.87 104.18 5.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.629 -0.878 . . . . 25.0 108.629 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -75.84 127.56 85.24 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 107.54 -1.281 . . . . 25.0 107.54 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.44 153.77 60.79 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 117.985 -0.877 . . . . 25.0 113.842 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -98.8 30.88 3.14 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.982 -1.488 . . . . 25.0 106.982 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 72.74 -18.8 0.33 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.041 1.737 . . . . 25.0 111.705 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -129.23 151.51 49.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 104.941 -2.244 . . . . 25.0 104.941 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 47.6 t -144.08 95.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.495 -1.298 . . . . 25.0 107.495 -178.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -91.42 133.7 35.25 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 163.22 31.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 104.975 -2.231 . . . . 25.0 104.975 177.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -136.93 149.62 47.71 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 105.341 -2.096 . . . . 25.0 105.341 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 163.95 31.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.668 -1.234 . . . . 25.0 107.668 -178.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -102.01 118.78 37.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.439 0.162 . . . . 25.0 111.125 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.4 mt -76.25 132.23 73.69 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -63.34 147.53 93.54 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-O 121.692 0.622 . . . . 25.0 113.576 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.03 -26.15 43.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.25 -0.886 . . . . 25.0 112.769 -169.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -82.09 7.24 13.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.602 0.715 . . . . 25.0 110.113 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -114.44 52.29 0.84 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 107.812 -1.181 . . . . 25.0 107.812 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.92 11.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.041 -1.836 . . . . 25.0 106.041 173.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.68 -168.65 41.94 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 116.116 1.206 . . . . 25.0 116.116 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.15 109.14 18.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.45 0.643 . . . . 25.0 110.881 -169.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.461 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.8 p-80 -158.24 171.32 20.41 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.91 -0.586 . . . . 25.0 111.406 -176.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.7 p -102.92 150.2 6.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 107.315 -1.365 . . . . 25.0 107.315 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.1 mt -133.21 127.81 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 102.201 -3.259 . . . . 25.0 102.201 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.0 mp -119.96 141.27 49.81 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.848 -0.614 . . . . 25.0 109.657 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.59 140.43 52.12 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.987 -0.745 . . . . 25.0 108.987 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -127.32 135.84 62.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.059 0.933 . . . . 25.0 112.325 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.7 t90 -95.11 111.43 23.25 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.876 -2.268 . . . . 25.0 104.876 170.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -98.16 119.33 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 -177.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.6 mm -86.44 141.35 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -170.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -83.52 -46.53 12.34 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.348 0.594 . . . . 25.0 110.848 175.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.16 -27.05 66.09 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.788 1.403 . . . . 25.0 114.788 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.2 p -138.06 164.29 29.47 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.172 -0.677 . . . . 25.0 109.172 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -77.85 26.79 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.621 0.971 . . . . 25.0 113.621 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -96.05 148.96 22.12 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.574 -0.704 . . . . 25.0 112.59 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.41 138.24 9.73 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 106.373 -1.714 . . . . 25.0 106.373 170.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -146.86 131.45 17.79 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.242 0.474 . . . . 25.0 112.204 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -91.18 118.01 30.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.156 -0.475 . . . . 25.0 111.449 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -96.99 113.92 25.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.423 -0.954 . . . . 25.0 108.423 178.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.47 142.95 27.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.746 -0.661 . . . . 25.0 112.713 -175.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.47 136.77 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.032 -2.21 . . . . 25.0 105.032 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -97.17 131.58 43.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.68 162.83 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 113.049 0.759 . . . . 25.0 113.049 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -120.06 95.07 4.6 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 167.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.424 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.86 161.09 15.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.158 0.799 . . . . 25.0 113.158 -171.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 66.0 p -145.85 166.45 25.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.83 -0.804 . . . . 25.0 108.83 175.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.755 0 CA-C-O 118.827 -0.606 . . . . 25.0 110.408 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.6 m80 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.471 0.653 . . . . 25.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.5 170.87 38.9 Favored Glycine 0 CA--C 1.509 -0.307 1 N-CA-C 101.282 -4.727 . . . . 25.0 101.282 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -141.72 154.92 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 120.144 1.972 . . . . 25.0 109.787 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.31 119.61 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 106.019 -1.845 . . . . 25.0 106.019 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.32 -44.61 36.05 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.314 -1.312 . . . . 25.0 110.338 -172.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -148.46 124.55 5.27 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -64.65 131.4 12.08 Favored 'Cis proline' 0 CA--C 1.536 0.617 0 C-N-CA 128.7 0.708 . . . . 25.0 111.766 -0.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.84 112.51 4.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -173.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 t -71.98 158.42 36.03 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.576 -0.528 . . . . 25.0 109.576 -178.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -55.33 -25.43 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.714 0.806 . . . . 25.0 112.08 178.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.33 -51.47 52.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.64 0.733 . . . . 25.0 109.296 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.13 -37.03 84.7 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.719 -0.673 . . . . 25.0 109.977 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.7 -32.46 73.56 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 122.344 -0.223 . . . . 25.0 110.97 178.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -40.82 96.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.559 . . . . 25.0 110.323 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.438 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.6 tmtm? -68.15 -34.44 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.27 0.557 . . . . 25.0 109.812 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.7 mt -78.0 6.58 7.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.043 -0.526 . . . . 25.0 111.681 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 59.15 23.19 11.43 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.218 1.407 . . . . 25.0 113.342 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.499 ' C ' HD22 ' A' ' 19' ' ' ASN . 90.2 mt -90.09 -21.08 22.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.491 -0.929 . . . . 25.0 108.491 174.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.499 HD22 ' C ' ' A' ' 18' ' ' LEU . 1.8 m120 -123.54 159.97 28.01 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 106.097 -1.816 . . . . 25.0 106.097 178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 p -135.69 174.59 10.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.566 0.347 . . . . 25.0 111.126 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 66.93 4.99 3.78 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 116.855 2.169 . . . . 25.0 116.855 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -64.89 -38.99 92.83 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 121.664 -0.648 . . . . 25.0 111.261 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.57 1.58 Allowed Glycine 0 C--O 1.217 -0.948 0 O-C-N 123.733 0.646 . . . . 25.0 111.92 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 t -88.07 -52.27 5.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.574 1.178 . . . . 25.0 110.994 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -7.13 7.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.33 -1.305 . . . . 25.0 113.53 -171.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -90.74 -0.74 57.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.851 -0.531 . . . . 25.0 111.302 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -116.39 -34.02 4.75 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.259 -0.577 . . . . 25.0 109.748 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.94 102.44 24.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.461 -0.57 . . . . 25.0 109.461 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.438 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 92.6 Cg_endo -74.37 -20.54 18.34 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 117.383 -1.278 . . . . 25.0 113.955 -174.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -87.03 14.96 6.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.432 0.53 . . . . 25.0 112.432 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 61.5 m -65.09 -21.33 66.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.989 0.424 . . . . 25.0 111.651 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.67 125.96 22.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 115.274 1.583 . . . . 25.0 115.274 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -152.93 159.77 42.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.127 -1.805 . . . . 25.0 106.127 172.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.01 -167.47 21.51 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 107.661 -2.176 . . . . 25.0 107.661 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -119.33 150.67 39.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 118.31 1.055 . . . . 25.0 111.916 -177.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -65.29 152.85 42.74 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.089 -1.448 . . . . 25.0 107.089 172.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.14 2.07 1.65 Allowed Glycine 0 C--N 1.317 -0.498 0 CA-C-N 115.091 -0.958 . . . . 25.0 114.153 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -75.97 140.64 70.5 Favored Pre-proline 0 C--N 1.322 -0.619 0 O-C-N 121.605 -0.938 . . . . 25.0 109.369 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -93.23 -13.45 20.46 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 C-N-CA 130.473 1.447 . . . . 25.0 115.607 -6.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.84 -37.42 76.17 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.489 1.292 . . . . 25.0 114.489 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.48 30.5 7.26 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.57 -179.93 44.83 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 114.384 -1.28 . . . . 25.0 110.79 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -62.54 173.35 3.6 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.985 2.457 . . . . 25.0 113.356 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 160.04 31.05 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 107.207 -1.405 . . . . 25.0 107.207 173.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -60.66 139.69 57.75 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 107.204 -1.406 . . . . 25.0 107.204 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.51 -5.89 79.35 Favored Glycine 0 CA--C 1.511 -0.184 0 CA-C-N 116.232 -0.44 . . . . 25.0 112.628 -174.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -124.97 8.86 8.08 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.517 -0.402 . . . . 25.0 109.954 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.32 -49.48 80.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 122.047 -0.408 . . . . 25.0 111.502 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.33 -16.96 59.64 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.992 -0.442 . . . . 25.0 110.102 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.7 p -87.28 -7.56 57.71 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.02 30.89 10.14 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.521 0.729 . . . . 25.0 110.464 -172.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.97 37.25 24.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.357 1.243 . . . . 25.0 114.357 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.2 135.71 54.89 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.938 0.495 . . . . 25.0 110.807 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 p -61.44 -34.78 76.0 Favored 'General case' 0 C--O 1.213 -0.827 0 N-CA-C 114.627 1.343 . . . . 25.0 114.627 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -69.2 -8.56 46.86 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -178.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -122.68 12.48 9.92 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 108.123 -1.065 . . . . 25.0 108.123 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -70.71 -39.58 73.36 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.901 -1.125 . . . . 25.0 111.176 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -73.38 -11.06 60.35 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.697 0.761 . . . . 25.0 109.423 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.1 mp -88.14 -3.09 58.93 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.768 -0.826 . . . . 25.0 108.768 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -114.11 -34.02 5.5 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.973 0.416 . . . . 25.0 111.357 172.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -86.6 116.1 24.5 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 121.78 -0.575 . . . . 25.0 110.375 -178.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.462 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.8 pm0 -125.46 160.9 28.31 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.401 0.619 . . . . 25.0 110.658 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.1 p -119.88 160.22 43.56 Favored Pre-proline 0 C--N 1.317 -0.816 1 N-CA-C 99.719 -4.178 . . . . 25.0 99.719 160.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.17 -2.63 10.79 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 N-CA-C 116.094 1.536 . . . . 25.0 116.094 -173.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -121.21 9.76 10.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.182 0.515 . . . . 25.0 111.361 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -79.65 -28.66 40.84 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.243 0.831 . . . . 25.0 113.243 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.2 m95 -126.6 168.35 14.43 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.773 0.321 . . . . 25.0 111.259 -176.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -69.6 119.38 13.75 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 106.75 -1.574 . . . . 25.0 106.75 171.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.3 mmtt -93.29 103.08 15.35 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 101.183 -3.636 . . . . 25.0 101.183 177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.79 135.58 55.07 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.917 -1.038 . . . . 25.0 110.621 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -89.69 102.41 15.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.177 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.6 173.85 10.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.577 -1.268 . . . . 25.0 107.577 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.16 157.36 24.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.937 -0.574 . . . . 25.0 111.243 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 139' ' ' ALA . 76.4 p -76.96 168.83 19.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 106.877 -1.527 . . . . 25.0 106.877 171.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.93 -160.93 26.56 Favored Glycine 0 C--O 1.239 0.468 0 N-CA-C 110.424 -1.071 . . . . 25.0 110.424 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.95 131.51 42.16 Favored 'Trans proline' 0 C--N 1.347 0.449 0 CA-C-N 119.061 1.43 . . . . 25.0 114.177 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -137.91 161.94 35.34 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 106.7 -1.592 . . . . 25.0 106.7 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.8 p -103.39 149.49 24.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.392 -1.336 . . . . 25.0 107.392 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -137.57 101.06 4.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.042 -2.207 . . . . 25.0 105.042 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.8 113.99 27.87 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.224 1.011 . . . . 25.0 110.046 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -95.48 146.94 24.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.028 -0.987 . . . . 25.0 108.697 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -124.97 114.45 19.15 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 103.655 -2.72 . . . . 25.0 103.655 179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.12 138.51 48.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.477 -0.783 . . . . 25.0 110.037 -173.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.0 t -101.0 14.53 31.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.241 1.02 . . . . 25.0 109.136 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.5 134.85 29.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.899 -0.591 . . . . 25.0 110.079 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -90.1 5.65 45.87 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.588 0.588 . . . . 25.0 112.588 -179.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.79 153.25 42.38 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.904 -0.406 . . . . 25.0 109.904 178.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 t -74.36 156.07 37.47 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.264 1.209 . . . . 25.0 114.264 -170.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -102.93 157.42 16.99 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -118.01 -14.93 9.97 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 111.541 0.2 . . . . 25.0 111.541 173.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.5 t -172.45 154.26 3.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.975 0.417 . . . . 25.0 111.897 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -126.63 139.05 53.47 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 104.3 -2.481 . . . . 25.0 104.3 167.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 16.8 mtt-85 -144.9 150.61 37.34 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.446 -0.946 . . . . 25.0 108.446 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -137.69 136.22 37.2 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.333 -1.728 . . . . 25.0 106.333 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -148.52 162.43 39.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.515 0.598 . . . . 25.0 110.022 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.99 166.0 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 113.478 0.918 . . . . 25.0 113.478 -167.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 13.2 p -80.98 162.39 23.86 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.688 -1.227 . . . . 25.0 107.688 169.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -62.39 158.39 48.58 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.31 -0.859 . . . . 25.0 108.994 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.03 -23.33 34.25 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 116.565 -1.823 . . . . 25.0 114.272 -173.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -113.87 32.06 6.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.576 0.351 . . . . 25.0 111.499 -175.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.4 p-90 -76.14 164.31 26.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.98 0.895 . . . . 25.0 112.541 -176.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -83.04 100.93 10.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.523 -1.217 . . . . 25.0 110.101 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.09 12.88 10.43 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.662 2.097 . . . . 25.0 116.662 -170.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.7 t -121.08 7.91 10.35 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.561 -0.903 . . . . 25.0 108.561 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.22 159.52 32.51 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 107.388 -1.338 . . . . 25.0 107.388 -174.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 158.04 57.04 Favored 'Trans proline' 0 C--N 1.346 0.435 0 O-C-N 121.894 0.418 . . . . 25.0 113.08 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.59 106.32 3.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.898 0.38 . . . . 25.0 110.522 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -103.42 153.66 20.26 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.808 -0.812 . . . . 25.0 108.808 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -64.69 -25.14 67.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.0 0.429 . . . . 25.0 111.484 177.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.12 64.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.623 -0.717 . . . . 25.0 112.221 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.1 t -80.66 -21.06 41.74 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.632 0.73 . . . . 25.0 110.983 -178.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 26.1 m-85 -86.56 152.1 22.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 115.2 1.555 . . . . 25.0 115.2 -176.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -95.67 92.82 6.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 102.692 -3.077 . . . . 25.0 102.692 163.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.42 -6.25 13.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -170.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -84.93 131.68 48.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.66 140.91 27.07 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 115.779 -2.347 . . . . 25.0 112.369 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -92.16 -11.87 34.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.382 0.512 . . . . 25.0 112.382 -177.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.4 m -148.98 66.75 1.04 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.503 0.321 . . . . 25.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -88.99 133.52 34.3 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 118.357 -1.337 . . . . 25.0 109.027 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -118.89 99.08 6.52 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 102.715 -3.069 . . . . 25.0 102.715 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -91.53 91.95 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.446 -1.687 . . . . 25.0 106.446 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -110.45 117.28 33.15 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.808 -1.182 . . . . 25.0 107.808 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.01 78.67 0.87 Allowed Glycine 0 CA--C 1.502 -0.772 0 CA-C-N 115.072 -0.967 . . . . 25.0 113.787 -169.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.59 22.21 6.82 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 121.015 -0.612 . . . . 25.0 113.906 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.67 106.71 4.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.802 0.811 . . . . 25.0 109.284 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.32 122.87 88.3 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.975 -1.121 . . . . 25.0 107.975 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -77.92 168.36 22.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 N-CA-C 114.633 0.974 . . . . 25.0 114.633 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -109.21 33.26 4.38 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.83 -18.36 0.31 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.823 1.649 . . . . 25.0 112.76 -177.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -128.58 152.8 47.91 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 104.823 -2.288 . . . . 25.0 104.823 168.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -140.49 95.02 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.0 m -94.85 122.75 37.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.109 -1.441 . . . . 25.0 107.109 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.69 167.05 19.44 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 105.73 -1.952 . . . . 25.0 105.73 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -130.31 151.0 51.29 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.256 -2.128 . . . . 25.0 105.256 175.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 160.5 38.4 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.219 -1.401 . . . . 25.0 107.219 -177.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -103.28 115.8 31.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.091 0.245 . . . . 25.0 111.072 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.29 132.45 73.14 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 107.508 -1.293 . . . . 25.0 107.508 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.47 146.74 96.79 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-O 121.699 0.625 . . . . 25.0 113.519 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.96 -24.91 37.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.219 -0.9 . . . . 25.0 112.658 -168.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -85.46 10.42 12.97 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.622 0.725 . . . . 25.0 110.103 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -116.53 53.53 0.88 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 171.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -85.99 170.97 11.8 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 84.95 -168.3 42.98 Favored Glycine 0 C--N 1.321 -0.295 0 N-CA-C 116.157 1.223 . . . . 25.0 116.157 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.5 t -85.9 108.87 18.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 25.0 111.097 -168.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.425 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 50.0 p-80 -157.46 171.38 20.48 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.993 -0.548 . . . . 25.0 111.388 -176.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.42 151.04 7.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 107.963 -1.125 . . . . 25.0 107.963 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -133.79 122.45 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -106.54 133.39 51.3 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.71 -0.677 . . . . 25.0 109.921 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.24 135.32 53.33 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 122.939 0.495 . . . . 25.0 110.227 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.96 145.87 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 122.13 0.967 . . . . 25.0 112.901 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -113.63 112.95 24.36 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.929 -1.878 . . . . 25.0 105.929 172.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.3 122.27 35.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.707 -1.22 . . . . 25.0 107.707 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 15.5 mm -79.14 141.72 14.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.153 -0.684 . . . . 25.0 109.153 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.32 -42.34 23.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.75 0.704 . . . . 25.0 109.845 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.88 -23.87 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.75 1.018 . . . . 25.0 113.75 -172.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 49.0 p -138.8 169.65 17.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.867 0.841 . . . . 25.0 110.149 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.92 19.01 0.91 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.308 -0.86 . . . . 25.0 112.356 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.05 146.17 24.53 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.26 0.837 . . . . 25.0 113.26 -175.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.65 143.19 11.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 105.291 -2.114 . . . . 25.0 105.291 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -148.06 128.35 13.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 111.632 0.234 . . . . 25.0 111.632 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -86.82 118.34 26.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.032 0.444 . . . . 25.0 110.679 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -96.99 115.44 27.43 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.258 -1.016 . . . . 25.0 108.258 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.7 142.38 29.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.131 -0.486 . . . . 25.0 111.921 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -127.15 136.22 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 105.1 -2.185 . . . . 25.0 105.1 166.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -97.02 130.63 44.31 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.054 -1.461 . . . . 25.0 107.054 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.17 162.5 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 113.101 0.778 . . . . 25.0 113.101 -174.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.67 94.99 4.66 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 104.382 -2.451 . . . . 25.0 104.382 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.54 163.76 14.48 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.4 p -145.9 164.09 33.08 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.954 -1.128 . . . . 25.0 107.954 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-O 117.74 -1.124 . . . . 25.0 111.536 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 121.086 0.469 . . . . 25.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.67 170.88 22.99 Favored Glycine 0 CA--C 1.509 -0.342 1 N-CA-C 101.652 -4.579 . . . . 25.0 101.652 -175.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -146.62 163.16 36.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 120.297 2.049 . . . . 25.0 110.687 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -97.86 121.87 48.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -41.79 53.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.624 -1.171 . . . . 25.0 109.863 -174.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.64 129.3 5.17 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 106.018 -1.845 . . . . 25.0 106.018 176.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -64.46 132.25 13.62 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 128.751 0.73 . . . . 25.0 111.093 -0.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.78 112.61 4.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.038 -0.528 . . . . 25.0 111.855 -172.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.8 t -71.93 158.34 36.2 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 108.185 -1.043 . . . . 25.0 108.185 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -55.57 -24.77 34.49 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.304 0.642 . . . . 25.0 112.049 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.17 -53.78 33.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.819 0.819 . . . . 25.0 109.43 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -67.65 -35.09 78.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.505 -0.77 . . . . 25.0 110.564 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.68 -33.0 74.66 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.111 -0.368 . . . . 25.0 110.734 178.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -40.79 98.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.347 0.594 . . . . 25.0 109.555 177.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -67.85 -35.03 77.85 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.215 0.531 . . . . 25.0 110.185 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.69 5.47 9.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 25.0 111.436 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 59.1 24.95 13.32 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.097 1.359 . . . . 25.0 112.78 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 19' ' ' ASN . 89.1 mt -91.14 -21.84 20.98 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.131 -1.063 . . . . 25.0 108.131 174.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.464 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -124.06 159.9 28.88 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.011 -1.848 . . . . 25.0 106.011 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.2 p -134.73 175.49 9.5 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 122.261 0.225 . . . . 25.0 110.508 -176.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 70.21 5.08 5.15 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.574 1.694 . . . . 25.0 115.574 175.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.9 m -66.66 -38.49 86.95 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 121.412 -0.805 . . . . 25.0 110.565 172.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.63 -63.94 1.48 Allowed Glycine 0 C--O 1.218 -0.861 0 O-C-N 123.754 0.659 . . . . 25.0 112.114 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.3 t -88.06 -52.82 5.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.423 1.106 . . . . 25.0 111.098 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.64 -9.97 12.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.697 -1.138 . . . . 25.0 113.54 -171.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.97 -3.06 58.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.857 -0.527 . . . . 25.0 111.266 177.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -116.25 -34.02 4.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.456 -0.572 . . . . 25.0 109.456 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -126.9 97.67 32.24 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 109.989 -0.375 . . . . 25.0 109.989 173.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -74.97 -20.73 16.65 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 118.041 -0.839 . . . . 25.0 113.956 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -84.14 11.01 8.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.471 0.545 . . . . 25.0 112.471 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.7 m -64.83 -22.57 67.02 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.448 0.536 . . . . 25.0 112.448 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 9.1 m -64.04 121.42 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 115.12 1.526 . . . . 25.0 115.12 -173.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -152.82 158.54 42.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 106.517 -1.66 . . . . 25.0 106.517 174.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.47 -166.18 18.76 Favored Glycine 0 N--CA 1.453 -0.209 0 N-CA-C 108.094 -2.003 . . . . 25.0 108.094 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -120.02 148.67 43.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.382 1.091 . . . . 25.0 112.079 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.39 157.0 33.0 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 171.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.25 2.02 1.64 Allowed Glycine 0 C--O 1.224 -0.493 0 CA-C-N 114.802 -1.09 . . . . 25.0 113.766 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -75.94 139.31 69.47 Favored Pre-proline 0 C--N 1.322 -0.622 0 O-C-N 121.576 -0.955 . . . . 25.0 110.067 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -93.45 -14.8 17.08 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 C-N-CA 130.35 1.396 . . . . 25.0 115.613 -6.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -70.98 -35.82 72.27 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.936 1.458 . . . . 25.0 114.936 -168.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -121.39 31.63 6.24 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 105.553 -2.018 . . . . 25.0 105.553 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.48 -177.61 41.45 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 114.389 -1.278 . . . . 25.0 111.749 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.3 172.5 3.26 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 123.505 2.803 . . . . 25.0 113.498 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 160.01 31.03 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.141 -1.429 . . . . 25.0 107.141 173.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -61.21 139.13 58.19 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.249 -1.389 . . . . 25.0 107.249 175.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.06 86.37 Favored Glycine 0 C--O 1.228 -0.275 0 CA-C-N 116.079 -0.51 . . . . 25.0 112.593 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -125.58 9.58 7.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.906 -0.775 . . . . 25.0 108.906 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.38 -49.51 74.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 122.132 -0.355 . . . . 25.0 111.631 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.1 -25.39 59.77 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.637 -0.505 . . . . 25.0 109.637 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.4 p -79.85 -9.77 59.7 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.181 0.437 . . . . 25.0 112.181 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.37 34.4 14.93 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.857 0.863 . . . . 25.0 109.984 -172.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.23 39.26 25.95 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.951 1.463 . . . . 25.0 114.951 -177.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -120.16 134.63 55.21 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.992 0.517 . . . . 25.0 110.614 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -61.68 -35.76 78.9 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 115.368 1.618 . . . . 25.0 115.368 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.03 -7.18 44.6 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.308 0.575 . . . . 25.0 112.456 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.7 m-85 -121.74 13.47 10.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -72.14 -37.29 69.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.192 -0.942 . . . . 25.0 110.841 -175.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.7 mp0 -69.81 -17.02 63.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.85 0.833 . . . . 25.0 109.802 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.26 -5.47 59.32 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.902 -0.777 . . . . 25.0 108.902 -177.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.55 -32.82 6.34 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.561 0.578 . . . . 25.0 112.561 173.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -97.61 119.49 36.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 O-C-N 121.458 -0.776 . . . . 25.0 110.629 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.475 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -123.92 160.95 26.39 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.383 -0.826 . . . . 25.0 109.596 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -117.29 162.48 27.91 Favored Pre-proline 0 C--N 1.317 -0.824 1 N-CA-C 99.908 -4.108 . . . . 25.0 99.908 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.33 -5.34 15.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 116.559 -1.828 . . . . 25.0 115.763 -174.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.25 10.38 9.29 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.177 0.513 . . . . 25.0 111.77 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -78.8 -28.77 44.62 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.042 0.756 . . . . 25.0 113.042 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.475 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.1 m95 -126.94 165.41 19.46 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 120.787 0.327 . . . . 25.0 110.463 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.58 131.41 45.95 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 105.959 -1.867 . . . . 25.0 105.959 170.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -101.2 106.85 18.11 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 101.06 -3.681 . . . . 25.0 101.06 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.21 136.18 51.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.952 -1.022 . . . . 25.0 110.329 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -90.23 104.04 16.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.802 -1.09 . . . . 25.0 108.478 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.3 mt -129.92 173.91 10.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.542 -1.281 . . . . 25.0 107.542 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.59 157.64 24.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.768 -0.651 . . . . 25.0 111.472 -174.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 69.6 p -77.04 169.52 18.18 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.154 -1.425 . . . . 25.0 107.154 172.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.2 -161.69 27.93 Favored Glycine 0 C--O 1.239 0.413 0 N-CA-C 110.702 -0.959 . . . . 25.0 110.702 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.88 132.2 46.28 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 119.012 1.406 . . . . 25.0 113.964 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -137.26 160.88 37.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.289 -1.745 . . . . 25.0 106.289 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.5 p -104.84 152.03 23.09 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.53 -1.285 . . . . 25.0 107.53 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -139.15 101.06 4.18 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.37 -2.085 . . . . 25.0 105.37 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.1 113.45 26.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.977 0.894 . . . . 25.0 109.924 -178.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -99.59 145.13 27.88 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.184 -0.917 . . . . 25.0 110.055 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -123.19 108.91 13.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.968 -2.234 . . . . 25.0 104.968 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -104.83 135.46 46.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.601 -0.727 . . . . 25.0 109.86 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.7 t -101.28 17.67 21.96 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.723 0.773 . . . . 25.0 109.95 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.29 141.35 33.94 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.992 -0.744 . . . . 25.0 108.992 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -85.29 -4.85 59.3 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.662 0.615 . . . . 25.0 112.662 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.85 155.13 31.51 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.564 0.579 . . . . 25.0 112.564 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -74.39 155.83 37.68 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -173.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.446 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 9.8 t -99.09 157.94 16.0 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.013 -1.106 . . . . 25.0 108.013 173.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -117.75 -16.62 10.0 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.738 0.273 . . . . 25.0 111.738 172.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 t -171.91 152.44 2.99 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.869 0.366 . . . . 25.0 111.886 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -124.95 139.63 53.65 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.389 -2.449 . . . . 25.0 104.389 167.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -144.56 148.67 34.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.128 -1.064 . . . . 25.0 108.128 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.95 134.69 35.24 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.64 161.37 42.31 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.364 0.529 . . . . 25.0 110.187 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 163.15 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.52 0.933 . . . . 25.0 113.52 -167.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 p -77.46 161.15 28.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.811 -1.181 . . . . 25.0 107.811 171.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -61.44 157.24 47.28 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.044 -0.98 . . . . 25.0 109.16 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.89 -23.6 34.75 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.95 -1.566 . . . . 25.0 114.13 -172.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -113.36 32.01 6.07 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 122.621 0.368 . . . . 25.0 111.544 -174.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -78.7 163.68 25.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.838 0.827 . . . . 25.0 111.587 -177.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -87.86 100.98 13.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.844 -1.071 . . . . 25.0 110.393 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -78.85 21.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 116.158 1.91 . . . . 25.0 116.158 -173.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -120.74 -0.78 10.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.37 0.605 . . . . 25.0 109.826 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -101.64 156.49 35.13 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.376 -0.829 . . . . 25.0 108.806 -176.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.39 158.27 57.84 Favored 'Trans proline' 0 C--N 1.346 0.437 0 O-C-N 121.882 0.411 . . . . 25.0 111.525 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.99 97.61 1.91 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.324 0.583 . . . . 25.0 112.105 -176.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.7 p -91.87 152.94 19.85 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.474 -0.935 . . . . 25.0 108.474 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -65.26 -25.48 67.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.246 0.546 . . . . 25.0 111.049 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.87 -27.1 66.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.419 -0.81 . . . . 25.0 112.295 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 t -84.65 -5.87 59.33 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.054 0.391 . . . . 25.0 112.054 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -100.7 154.21 18.8 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 114.105 1.15 . . . . 25.0 114.105 -175.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -94.59 93.92 7.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 102.633 -3.099 . . . . 25.0 102.633 163.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.34 -7.3 23.6 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -169.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.8 t -83.68 128.31 64.18 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 176.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.71 146.51 48.79 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 115.278 -2.682 . . . . 25.0 111.336 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -97.11 -10.23 26.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.979 0.419 . . . . 25.0 111.527 -177.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.3 m -148.97 67.25 1.04 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.57 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -88.98 132.33 34.77 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 118.967 -1.093 . . . . 25.0 108.79 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -124.41 98.98 5.98 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 104.738 -2.319 . . . . 25.0 104.738 177.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -92.55 92.16 7.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -103.74 117.61 34.78 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 107.278 -1.379 . . . . 25.0 107.278 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -97.71 78.35 0.63 Allowed Glycine 0 CA--C 1.504 -0.636 0 CA-C-N 115.447 -0.797 . . . . 25.0 114.021 -169.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 112.3 22.0 6.01 Favored Glycine 0 C--N 1.321 -0.28 0 C-N-CA 120.817 -0.706 . . . . 25.0 113.203 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.68 107.03 5.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.531 0.681 . . . . 25.0 109.363 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.06 123.0 88.61 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 106.036 -1.838 . . . . 25.0 106.036 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.91 171.6 17.69 Favored 'Trans proline' 0 C--N 1.345 0.343 0 N-CA-C 113.715 0.621 . . . . 25.0 113.715 -175.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.11 27.27 5.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.581 -0.896 . . . . 25.0 108.581 176.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.56 -17.77 0.27 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.716 1.607 . . . . 25.0 112.365 -174.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 128' ' ' ALA . 67.5 mt-30 -127.23 153.33 46.24 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 103.494 -2.78 . . . . 25.0 103.494 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 69.5 t -141.41 95.08 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.604 0 N-CA-C 106.263 -1.754 . . . . 25.0 106.263 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.5 t -85.96 143.79 27.98 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 103.557 -2.757 . . . . 25.0 103.557 172.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.04 167.0 29.86 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.933 -1.485 . . . . 25.0 107.59 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -134.67 156.05 49.44 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.654 -1.61 . . . . 25.0 106.654 174.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.6 160.34 25.71 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.098 -1.445 . . . . 25.0 107.098 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -104.75 116.96 32.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.054 0.222 . . . . 25.0 110.979 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.86 132.12 68.66 Favored Pre-proline 0 CA--C 1.54 0.576 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -61.96 147.94 94.14 Favored 'Trans proline' 0 C--N 1.352 0.716 0 CA-C-O 121.652 0.605 . . . . 25.0 113.474 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.57 -26.54 34.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.32 -0.855 . . . . 25.0 112.594 -169.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -83.6 10.1 9.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.602 0.715 . . . . 25.0 110.305 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.3 mmt-85 -116.34 50.0 1.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.568 -0.901 . . . . 25.0 108.568 172.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 35.9 p -86.0 164.94 17.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.672 -1.603 . . . . 25.0 106.672 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.97 -167.94 31.0 Favored Glycine 0 N--CA 1.451 -0.339 0 N-CA-C 115.043 0.777 . . . . 25.0 115.043 177.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -85.99 111.03 19.89 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.369 0.604 . . . . 25.0 110.908 -168.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.427 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 48.5 p-80 -159.14 171.08 20.59 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 115.913 -0.585 . . . . 25.0 111.241 -176.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.0 p -104.75 150.5 7.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.6 mt -132.24 120.99 45.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.83 131.53 52.19 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.394 -0.821 . . . . 25.0 109.62 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -123.59 133.14 54.0 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.519 -0.549 . . . . 25.0 109.519 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.46 143.78 36.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 122.073 0.939 . . . . 25.0 112.356 -178.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.446 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.8 t90 -113.8 113.22 24.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.872 -1.899 . . . . 25.0 105.872 173.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.64 125.74 38.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.981 -1.118 . . . . 25.0 107.981 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.6 mm -80.71 142.1 14.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.901 -0.777 . . . . 25.0 108.901 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.53 -43.49 22.99 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 118.806 0.73 . . . . 25.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.2 -23.24 64.81 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.749 1.018 . . . . 25.0 113.749 -172.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.1 p -138.63 168.76 19.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.962 0.887 . . . . 25.0 110.022 -175.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.88 21.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.216 -0.902 . . . . 25.0 112.313 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -91.63 145.27 24.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.076 0.769 . . . . 25.0 113.076 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.55 143.58 13.29 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 105.106 -2.183 . . . . 25.0 105.106 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -148.55 129.77 14.62 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.137 0.421 . . . . 25.0 112.137 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -85.53 117.37 24.39 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 121.105 0.479 . . . . 25.0 111.063 177.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -97.12 108.19 20.87 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.318 -1.364 . . . . 25.0 107.318 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.16 142.76 30.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.829 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -126.9 136.1 61.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 105.424 -2.065 . . . . 25.0 105.424 168.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -97.02 129.11 44.52 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.51 163.07 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.157 0.799 . . . . 25.0 113.157 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -117.83 95.28 4.85 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 103.994 -2.595 . . . . 25.0 103.994 166.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.6 tp -89.94 163.04 15.12 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 120.909 0.385 . . . . 25.0 111.652 -172.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.0 p -145.85 158.03 43.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 118.113 -0.946 . . . . 25.0 111.368 -178.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.0 m170 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 110.599 -0.149 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.23 166.09 11.89 Favored Glycine 0 N--CA 1.459 0.217 1 N-CA-C 102.758 -4.137 . . . . 25.0 102.758 -174.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.2 p90 -149.38 168.12 24.27 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.444 2.122 . . . . 25.0 111.921 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -103.82 124.37 58.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.565 -1.272 . . . . 25.0 107.565 176.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.89 -43.18 30.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.922 -1.036 . . . . 25.0 109.968 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -152.89 129.8 5.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.923 -1.88 . . . . 25.0 105.923 176.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.76 130.79 9.84 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.933 0.806 . . . . 25.0 111.451 0.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.76 4.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.875 -0.602 . . . . 25.0 112.11 -172.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.7 t -72.14 157.34 37.93 Favored 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 108.667 -0.864 . . . . 25.0 108.667 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -55.2 -25.61 33.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.726 0.81 . . . . 25.0 111.924 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.26 30.21 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.824 0.821 . . . . 25.0 109.157 175.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -66.48 -35.74 81.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.498 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.3 -33.36 75.35 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 122.157 -0.34 . . . . 25.0 110.849 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -39.79 94.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.225 0.536 . . . . 25.0 109.862 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -68.21 -35.19 77.59 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.226 0.536 . . . . 25.0 110.034 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -77.77 4.4 11.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 25.0 111.278 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 58.95 22.39 10.29 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.175 1.39 . . . . 25.0 112.975 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.457 ' C ' HD22 ' A' ' 19' ' ' ASN . 92.8 mt -86.55 -21.69 26.76 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 174.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.457 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -123.75 158.81 30.84 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 105.435 -2.061 . . . . 25.0 105.435 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.3 p -135.81 176.95 8.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.439 -0.578 . . . . 25.0 109.439 -176.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 71.3 5.13 5.33 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.442 1.645 . . . . 25.0 115.442 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -68.76 -38.13 79.87 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 121.53 -0.732 . . . . 25.0 110.821 174.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.8 -63.62 1.55 Allowed Glycine 0 C--O 1.217 -0.924 0 O-C-N 123.713 0.633 . . . . 25.0 112.116 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.8 t -88.0 -53.31 4.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 122.503 1.144 . . . . 25.0 111.643 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.9 OUTLIER -68.28 -11.11 13.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.563 -1.199 . . . . 25.0 113.239 -171.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -86.91 -2.71 58.81 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.751 -0.593 . . . . 25.0 111.479 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -116.25 -34.11 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.129 -0.628 . . . . 25.0 109.594 173.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -126.9 92.44 44.55 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 120.926 0.393 . . . . 25.0 111.463 171.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.401 ' HA ' HG12 ' A' ' 25' ' ' VAL . 85.6 Cg_endo -74.15 -19.13 20.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 117.66 -1.093 . . . . 25.0 114.022 -176.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.99 5.38 41.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.231 0.456 . . . . 25.0 112.231 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -2.28 24.33 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.993 0.738 . . . . 25.0 112.993 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.3 m -64.08 138.03 23.76 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 N-CA-C 113.343 0.868 . . . . 25.0 113.343 -177.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -153.02 152.28 31.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.345 -0.843 . . . . 25.0 108.779 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.58 -176.35 33.58 Favored Glycine 0 N--CA 1.452 -0.256 0 N-CA-C 107.346 -2.302 . . . . 25.0 107.346 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.84 150.3 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 118.364 1.082 . . . . 25.0 111.758 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.52 156.98 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.602 -1.258 . . . . 25.0 107.602 172.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.82 -1.74 3.57 Favored Glycine 0 C--O 1.224 -0.504 0 CA-C-N 114.756 -1.111 . . . . 25.0 112.797 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -75.98 142.1 72.22 Favored Pre-proline 0 C--N 1.322 -0.617 0 O-C-N 121.546 -0.973 . . . . 25.0 109.374 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -91.89 -13.74 23.15 Favored 'Cis proline' 0 CA--C 1.541 0.87 0 C-N-CA 130.065 1.277 . . . . 25.0 115.227 -6.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -70.71 -37.81 73.57 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.782 1.401 . . . . 25.0 114.782 -169.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.79 34.95 5.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.118 -1.808 . . . . 25.0 106.118 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.45 -174.41 46.06 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 114.613 -1.176 . . . . 25.0 111.311 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -59.8 173.71 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 124.257 3.305 . . . . 25.0 113.049 176.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.95 159.92 31.22 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.915 -1.513 . . . . 25.0 106.915 173.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -61.03 139.36 58.08 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.24 -5.05 81.98 Favored Glycine 0 C--O 1.228 -0.224 0 CA-C-N 116.06 -0.518 . . . . 25.0 112.826 -174.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -124.2 10.88 8.74 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.26 -0.644 . . . . 25.0 109.26 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.63 -49.96 74.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 122.272 -0.267 . . . . 25.0 111.291 -174.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.39 -24.66 59.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.709 -0.478 . . . . 25.0 109.709 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 p -80.45 -9.74 59.75 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.269 0.47 . . . . 25.0 112.269 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.28 34.43 14.73 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.689 0.795 . . . . 25.0 110.267 -172.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.55 41.16 26.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.467 1.284 . . . . 25.0 114.467 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -121.31 136.26 54.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.345 0.658 . . . . 25.0 110.529 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -63.5 -35.26 79.89 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -175.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.03 -7.12 47.01 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.621 0.6 . . . . 25.0 112.621 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.689 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.4 m-85 -120.13 13.58 12.1 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 107.14 -1.43 . . . . 25.0 107.14 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.54 -35.71 68.1 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.998 -1.064 . . . . 25.0 110.604 -175.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 -69.26 -17.37 63.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.923 0.868 . . . . 25.0 109.646 174.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.689 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.44 -5.36 59.18 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.485 -0.78 . . . . 25.0 109.007 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -113.97 -32.6 6.01 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.284 0.476 . . . . 25.0 112.284 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -91.65 115.89 28.42 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 121.583 -0.698 . . . . 25.0 110.34 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.457 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -125.17 161.02 27.79 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.149 -0.686 . . . . 25.0 109.149 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -116.55 163.96 20.2 Favored Pre-proline 0 C--N 1.317 -0.827 0 N-CA-C 100.348 -3.945 . . . . 25.0 100.348 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.88 -4.04 12.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 116.74 -1.707 . . . . 25.0 115.86 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -127.98 12.52 6.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.355 0.598 . . . . 25.0 111.506 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -76.6 -28.8 56.28 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.283 0.846 . . . . 25.0 113.283 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.4 m95 -126.14 167.12 15.83 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 120.598 0.237 . . . . 25.0 110.557 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -66.68 119.86 12.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.815 -1.921 . . . . 25.0 105.815 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -94.0 103.5 15.58 Favored 'General case' 0 CA--C 1.5 -0.975 1 N-CA-C 100.094 -4.039 . . . . 25.0 100.094 177.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.31 135.05 54.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.926 -1.034 . . . . 25.0 110.312 -176.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -90.4 101.09 13.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.648 -1.16 . . . . 25.0 108.296 -177.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -129.38 173.89 10.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.673 -1.232 . . . . 25.0 107.673 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.25 155.36 25.21 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 25.0 111.709 -174.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.414 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.9 p -76.99 167.99 20.87 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 172.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.1 -160.89 25.18 Favored Glycine 0 C--O 1.24 0.487 0 N-CA-C 110.609 -0.997 . . . . 25.0 110.609 -178.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.99 133.62 54.67 Favored 'Trans proline' 0 C--N 1.346 0.446 0 CA-C-N 119.019 1.41 . . . . 25.0 113.931 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -138.79 160.74 38.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.797 -1.557 . . . . 25.0 106.797 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -103.1 151.12 22.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.329 -1.359 . . . . 25.0 107.329 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -138.57 101.04 4.25 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 105.455 -2.054 . . . . 25.0 105.455 -177.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.61 116.45 32.09 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.949 0.88 . . . . 25.0 109.132 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -104.07 150.37 24.35 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.218 -0.901 . . . . 25.0 109.794 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -127.79 111.67 13.91 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.0 mp -109.22 122.36 47.16 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.633 -0.712 . . . . 25.0 111.71 -173.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.5 17.69 4.39 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.479 0.657 . . . . 25.0 111.227 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.33 140.37 33.77 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 121.615 -0.678 . . . . 25.0 110.133 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -82.55 -8.55 59.6 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.852 -0.613 . . . . 25.0 112.025 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -63.8 156.18 28.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -175.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.6 t -83.36 155.99 23.25 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 114.239 1.2 . . . . 25.0 114.239 -171.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -99.65 157.22 16.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.876 -0.602 . . . . 25.0 109.469 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -117.94 -14.22 10.03 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.559 0.207 . . . . 25.0 111.559 172.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.1 t -172.61 150.31 2.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.807 0.337 . . . . 25.0 111.824 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -122.86 139.5 53.95 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 104.521 -2.4 . . . . 25.0 104.521 166.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -144.75 151.83 39.45 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.454 -1.313 . . . . 25.0 107.454 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.94 134.39 34.89 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.75 -1.945 . . . . 25.0 105.75 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 164.01 34.72 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.345 0.52 . . . . 25.0 109.881 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.92 164.28 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 113.481 0.919 . . . . 25.0 113.481 -167.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -78.65 162.36 26.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -62.07 157.77 49.78 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.264 -0.88 . . . . 25.0 109.065 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.33 -25.34 36.31 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 116.534 -1.844 . . . . 25.0 114.036 -173.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -113.0 31.99 6.03 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.694 0.397 . . . . 25.0 110.882 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.67 165.02 25.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.031 0.919 . . . . 25.0 112.982 -175.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -83.1 100.93 10.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.496 -1.229 . . . . 25.0 109.857 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -88.14 12.2 14.28 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 116.693 2.109 . . . . 25.0 116.693 -169.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.4 t -119.23 6.45 11.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 176.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -109.71 156.62 39.44 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.666 -1.152 . . . . 25.0 108.042 -174.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.53 156.85 64.39 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 O-C-N 121.942 0.443 . . . . 25.0 111.847 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.05 105.17 3.24 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.28 0.562 . . . . 25.0 112.075 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.0 p -98.64 154.82 17.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.772 -0.825 . . . . 25.0 108.772 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -65.0 -26.05 68.12 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.913 -0.492 . . . . 25.0 111.484 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.84 -26.95 65.41 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.702 -0.681 . . . . 25.0 112.112 176.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 35.3 t -83.34 -5.39 59.13 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -101.96 153.7 19.63 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -94.86 95.42 8.66 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 102.556 -3.128 . . . . 25.0 102.556 163.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.1 mt -67.06 -6.81 18.79 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -169.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.1 t -86.95 131.28 45.42 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.951 -0.759 . . . . 25.0 108.951 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -72.64 149.63 49.36 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 115.54 -2.506 . . . . 25.0 111.446 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -99.62 -12.07 20.39 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.151 0.426 . . . . 25.0 112.151 -177.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.7 m -147.47 65.86 1.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.366 -0.379 . . . . 25.0 110.357 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -88.99 135.87 33.32 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 118.458 -1.297 . . . . 25.0 109.176 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -123.19 99.13 6.2 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 103.406 -2.813 . . . . 25.0 103.406 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -91.83 92.06 8.2 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 106.535 -1.654 . . . . 25.0 106.535 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -109.91 119.32 38.97 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 107.984 -1.117 . . . . 25.0 107.984 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.64 77.94 0.82 Allowed Glycine 0 CA--C 1.503 -0.713 0 CA-C-N 115.33 -0.85 . . . . 25.0 113.844 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.98 23.56 6.39 Favored Glycine 0 C--N 1.32 -0.306 0 C-N-CA 120.899 -0.667 . . . . 25.0 114.08 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.06 105.89 4.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.792 0.806 . . . . 25.0 110.005 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 87.7 mt -69.97 127.06 92.67 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 106.596 -1.631 . . . . 25.0 106.596 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.17 169.73 21.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 N-CA-C 113.998 0.73 . . . . 25.0 113.998 -176.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.417 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.89 30.86 4.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.784 -1.191 . . . . 25.0 107.784 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.61 -21.02 0.22 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.997 1.719 . . . . 25.0 111.969 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.417 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.7 mt-30 -126.64 156.56 40.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 104.219 -2.512 . . . . 25.0 104.219 169.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -138.96 95.07 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.134 -2.173 . . . . 25.0 105.134 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.7 t -87.84 139.98 29.97 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.936 -2.616 . . . . 25.0 103.936 174.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -152.62 166.93 30.55 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 113.883 -1.508 . . . . 25.0 108.779 -175.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -135.44 155.89 49.8 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.058 -1.83 . . . . 25.0 106.058 174.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.06 161.32 25.27 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.019 -1.474 . . . . 25.0 107.019 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -105.89 118.65 37.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.992 0.182 . . . . 25.0 110.868 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.2 131.9 61.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -61.99 147.2 95.62 Favored 'Trans proline' 0 C--N 1.353 0.784 0 CA-C-O 121.615 0.59 . . . . 25.0 113.456 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.414 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.75 -25.69 35.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 25.0 112.526 -169.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -83.58 9.74 10.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.684 0.754 . . . . 25.0 110.192 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.99 52.97 0.88 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.4 p -86.0 166.92 15.51 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.983 -1.488 . . . . 25.0 106.983 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.74 -166.76 34.43 Favored Glycine 0 C--O 1.238 0.389 0 N-CA-C 115.926 1.131 . . . . 25.0 115.926 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.0 t -86.01 107.6 17.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.436 0.636 . . . . 25.0 110.813 -168.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -157.93 171.27 20.56 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.774 -0.648 . . . . 25.0 110.871 -176.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.57 149.98 7.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.64 -1.245 . . . . 25.0 107.64 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.99 127.71 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 101.665 -3.458 . . . . 25.0 101.665 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.92 132.0 56.81 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.711 -0.477 . . . . 25.0 109.711 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -110.92 128.69 55.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.6 p -122.29 137.93 54.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.991 0.9 . . . . 25.0 111.014 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.4 t90 -115.71 116.19 27.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.783 -1.553 . . . . 25.0 107.008 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.3 126.91 40.93 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.959 -1.126 . . . . 25.0 107.959 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 18.8 mm -82.6 140.96 15.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.19 -43.07 29.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.824 0.738 . . . . 25.0 110.014 176.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.36 -23.59 64.7 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 114.092 1.145 . . . . 25.0 114.092 -172.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.4 p -138.78 169.76 17.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.993 0.901 . . . . 25.0 110.118 -174.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.28 19.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.142 -0.935 . . . . 25.0 112.491 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -90.04 146.99 23.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.852 0.686 . . . . 25.0 112.852 -176.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.03 141.74 15.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 104.576 -2.379 . . . . 25.0 104.576 170.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -146.39 134.79 21.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.262 0.467 . . . . 25.0 112.262 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -91.56 115.1 27.77 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.918 0.762 . . . . 25.0 110.808 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -97.05 108.1 20.76 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.446 -1.316 . . . . 25.0 107.446 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.38 139.99 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.377 -0.829 . . . . 25.0 111.757 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 132.86 70.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 105.311 -2.107 . . . . 25.0 105.311 167.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -94.02 130.41 40.16 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.981 -1.489 . . . . 25.0 106.981 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.4 m -131.81 161.35 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.912 0.708 . . . . 25.0 112.912 -175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -117.71 95.0 4.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 103.654 -2.721 . . . . 25.0 103.654 166.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.4 HD23 HG22 ' A' ' 74' ' ' THR . 2.8 tp -89.93 161.27 16.0 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.086 0.47 . . . . 25.0 111.825 -171.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.2 p -145.86 164.29 32.41 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.815 -0.809 . . . . 25.0 108.815 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.707 0 CA-C-O 118.041 -0.98 . . . . 25.0 110.378 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.9 m80 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.246 0.546 . . . . 25.0 110.372 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.41 177.53 35.51 Favored Glycine 0 CA--C 1.508 -0.348 1 N-CA-C 101.717 -4.553 . . . . 25.0 101.717 -176.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -148.16 165.82 29.74 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.019 1.91 . . . . 25.0 109.414 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -100.59 122.43 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 106.481 -1.674 . . . . 25.0 106.481 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.24 -43.21 52.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.708 -1.133 . . . . 25.0 109.859 -173.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.69 129.76 5.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.194 -1.78 . . . . 25.0 106.194 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.43 130.83 10.69 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.89 0.788 . . . . 25.0 111.386 -0.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.21 113.4 5.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.985 -0.552 . . . . 25.0 112.334 -172.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -72.1 158.23 36.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.038 -0.727 . . . . 25.0 109.038 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -55.32 -25.23 33.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.387 0.675 . . . . 25.0 112.02 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.35 36.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.782 0.801 . . . . 25.0 109.455 176.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -67.61 -35.7 79.44 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.456 -0.793 . . . . 25.0 110.301 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -63.6 -33.18 75.04 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 120.97 -0.292 . . . . 25.0 110.759 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -40.31 96.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.257 0.551 . . . . 25.0 110.092 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.3 tmtm? -68.14 -35.4 78.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.28 0.562 . . . . 25.0 110.071 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.88 4.43 9.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.098 -0.501 . . . . 25.0 111.518 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 58.75 23.69 11.43 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.22 1.408 . . . . 25.0 112.851 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.448 ' C ' HD22 ' A' ' 19' ' ' ASN . 87.8 mt -87.89 -22.43 24.4 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.611 -1.255 . . . . 25.0 107.611 174.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.448 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.62 159.34 29.48 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 105.316 -2.105 . . . . 25.0 105.316 177.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -135.36 175.23 9.78 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.352 -0.24 . . . . 25.0 110.352 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 70.32 5.4 5.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.783 1.771 . . . . 25.0 115.783 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.47 -34.44 77.94 Favored 'General case' 0 CA--C 1.497 -1.059 0 O-C-N 121.375 -0.828 . . . . 25.0 110.359 172.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.36 -64.14 1.38 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.9 0.75 . . . . 25.0 112.153 179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.9 t -87.98 -53.41 4.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 122.539 1.162 . . . . 25.0 111.633 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.18 -10.73 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 114.523 -1.217 . . . . 25.0 113.233 -171.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -85.5 -3.53 58.89 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.917 -0.489 . . . . 25.0 111.13 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -115.66 -34.09 4.97 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.407 -0.517 . . . . 25.0 110.005 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -126.94 98.81 29.94 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 120.672 0.273 . . . . 25.0 110.798 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.0 Cg_endo -76.92 -20.77 12.92 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 117.619 -1.121 . . . . 25.0 114.312 -174.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -82.27 9.06 9.56 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.211 0.449 . . . . 25.0 112.211 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -64.94 -23.2 67.15 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.15 0.796 . . . . 25.0 113.15 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.06 122.95 15.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 115.226 1.565 . . . . 25.0 115.226 -172.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.93 159.1 42.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 105.778 -1.934 . . . . 25.0 105.778 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.15 -168.58 23.23 Favored Glycine 0 N--CA 1.454 -0.156 0 N-CA-C 108.879 -1.689 . . . . 25.0 108.879 -177.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.4 tp -115.11 147.36 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.241 1.021 . . . . 25.0 112.062 -177.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -65.56 157.03 30.84 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.033 -0.729 . . . . 25.0 109.033 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.57 0.14 2.38 Favored Glycine 0 C--O 1.222 -0.646 0 CA-C-N 114.504 -1.225 . . . . 25.0 113.732 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -75.87 138.36 69.57 Favored Pre-proline 0 C--N 1.322 -0.628 0 O-C-N 121.402 -1.057 . . . . 25.0 110.815 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -92.77 -14.73 18.69 Favored 'Cis proline' 0 CA--C 1.544 0.98 0 C-N-CA 130.259 1.358 . . . . 25.0 115.385 -7.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -69.38 -35.62 76.0 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.162 1.541 . . . . 25.0 115.162 -168.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.97 34.1 4.94 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 105.846 -1.909 . . . . 25.0 105.846 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.78 -170.75 40.36 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.489 -1.232 . . . . 25.0 111.748 -176.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -60.5 170.39 4.34 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.994 2.462 . . . . 25.0 113.104 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 159.84 31.2 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.729 -1.582 . . . . 25.0 106.729 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -61.75 140.26 58.23 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.43 85.6 Favored Glycine 0 N--CA 1.453 -0.206 0 CA-C-N 115.782 -0.645 . . . . 25.0 112.373 -174.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -125.85 12.75 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.954 -0.387 . . . . 25.0 109.954 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.45 -52.87 46.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.122 -0.361 . . . . 25.0 111.824 -173.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.15 -20.04 59.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.889 -0.507 . . . . 25.0 109.969 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 p -83.24 -9.43 59.14 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.889 -0.325 . . . . 25.0 111.826 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.07 34.21 13.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.822 0.849 . . . . 25.0 110.342 -172.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.07 37.33 24.29 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.666 1.358 . . . . 25.0 114.666 -177.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.95 134.7 55.3 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.039 0.536 . . . . 25.0 110.891 175.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 p -62.27 -33.88 75.48 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 115.19 1.552 . . . . 25.0 115.19 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 t -70.67 -8.22 50.33 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.145 0.498 . . . . 25.0 112.296 -178.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.721 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.9 m-85 -120.5 15.83 12.06 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 107.544 -1.28 . . . . 25.0 107.544 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -70.4 -40.48 73.87 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.146 -0.971 . . . . 25.0 111.739 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.59 -15.35 63.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.91 0.862 . . . . 25.0 109.942 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.721 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.65 -6.55 59.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.73 -0.841 . . . . 25.0 108.73 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -112.28 -33.73 6.12 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.236 0.828 . . . . 25.0 113.236 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -96.21 119.41 34.64 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 121.424 -0.798 . . . . 25.0 110.907 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -125.94 161.03 28.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.971 -1.013 . . . . 25.0 109.919 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 53.8 p -116.13 160.66 34.73 Favored Pre-proline 0 C--N 1.319 -0.747 1 N-CA-C 99.857 -4.127 . . . . 25.0 99.857 160.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -70.37 -0.49 7.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 116.995 -1.537 . . . . 25.0 115.794 -174.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.93 10.02 8.83 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.108 0.48 . . . . 25.0 111.471 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -78.49 -29.28 46.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.888 0.699 . . . . 25.0 112.888 -176.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.496 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 5.6 m95 -126.65 165.55 19.0 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.856 -0.424 . . . . 25.0 109.856 -179.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -67.22 131.4 45.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -100.03 105.45 17.12 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 101.325 -3.583 . . . . 25.0 101.325 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.7 136.25 52.6 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.929 -1.032 . . . . 25.0 111.057 -177.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -87.79 106.75 18.28 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.948 -1.024 . . . . 25.0 109.051 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.1 mt -132.38 173.73 10.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 157.94 23.32 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.768 -0.651 . . . . 25.0 110.843 -174.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.448 HG21 ' HA ' ' A' ' 139' ' ' ALA . 64.8 p -77.06 169.8 17.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.099 -1.445 . . . . 25.0 107.099 172.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 89.82 -160.35 28.67 Favored Glycine 0 C--O 1.239 0.439 0 N-CA-C 110.602 -0.999 . . . . 25.0 110.602 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.27 132.32 45.99 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 119.087 1.443 . . . . 25.0 114.218 -177.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.88 161.43 36.65 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.281 -1.748 . . . . 25.0 106.281 178.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 p -104.35 151.15 23.81 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.616 -1.254 . . . . 25.0 107.616 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -139.31 100.95 4.13 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.83 115.04 29.82 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 122.169 0.985 . . . . 25.0 109.483 -179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.7 m95 -101.17 148.43 25.1 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.964 -1.016 . . . . 25.0 109.701 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.9 111.1 13.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.215 -2.143 . . . . 25.0 105.215 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.73 128.49 56.44 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.619 0.768 . . . . 25.0 111.73 -173.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -32.61 23.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.315 0.579 . . . . 25.0 109.623 174.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.4 122.01 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.842 0.353 . . . . 25.0 110.54 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -82.59 3.33 29.15 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.78 152.98 44.47 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.653 -0.419 . . . . 25.0 109.997 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -68.99 156.0 39.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 114.308 1.225 . . . . 25.0 114.308 -171.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.408 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 13.4 t -96.88 159.78 14.73 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.181 -1.044 . . . . 25.0 108.181 173.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.9 t -117.86 -16.13 9.97 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 123.143 0.277 . . . . 25.0 110.442 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.53 160.2 4.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.207 0.527 . . . . 25.0 112.224 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -128.48 134.93 48.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.071 -2.566 . . . . 25.0 104.071 168.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -140.34 150.05 43.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.873 -0.788 . . . . 25.0 108.873 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.94 138.14 38.67 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.641 -1.614 . . . . 25.0 106.641 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -149.62 161.57 41.9 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.545 0.611 . . . . 25.0 110.305 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.96 163.29 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 114.014 1.116 . . . . 25.0 114.014 -169.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 21.9 p -77.73 164.19 25.48 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.238 -1.023 . . . . 25.0 108.238 171.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -64.3 159.75 55.65 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 107.838 -1.171 . . . . 25.0 107.838 176.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -68.57 -26.37 33.9 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 115.921 -2.253 . . . . 25.0 113.983 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -114.08 32.01 6.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.881 0.473 . . . . 25.0 111.037 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.471 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -68.39 168.85 11.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.05 0.929 . . . . 25.0 112.91 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -83.17 100.97 10.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.602 -1.181 . . . . 25.0 109.461 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.471 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -92.86 8.9 37.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.895 1.813 . . . . 25.0 115.895 -169.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.4 t -125.62 13.69 8.09 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.644 -0.872 . . . . 25.0 108.644 177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -116.94 158.61 43.57 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.281 -1.327 . . . . 25.0 107.677 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -65.69 152.7 80.93 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 118.22 -0.72 . . . . 25.0 111.248 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mp -69.53 101.97 1.72 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.786 0.661 . . . . 25.0 112.786 -175.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.3 p -95.44 153.75 17.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.876 -1.157 . . . . 25.0 107.876 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -64.13 -24.51 67.72 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.065 0.459 . . . . 25.0 111.559 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.4 -26.79 67.41 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 25.0 112.415 177.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -80.59 -6.57 58.48 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.598 0.592 . . . . 25.0 112.598 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 50.5 m-85 -105.41 157.51 17.3 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -175.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.14 96.25 7.98 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 102.606 -3.109 . . . . 25.0 102.606 162.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.98 -6.82 24.24 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.938 1.459 . . . . 25.0 114.938 -169.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.4 t -79.88 133.47 58.34 Favored Pre-proline 0 C--N 1.321 -0.635 0 N-CA-C 108.995 -0.742 . . . . 25.0 108.995 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -72.37 148.38 48.73 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 114.824 -2.984 . . . . 25.0 110.596 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -102.67 -8.32 21.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.032 0.444 . . . . 25.0 111.277 -179.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.23 68.86 1.04 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.962 -0.563 . . . . 25.0 109.894 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -88.93 129.39 35.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 119.488 -0.885 . . . . 25.0 108.931 177.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -121.45 98.98 6.22 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 104.272 -2.492 . . . . 25.0 104.272 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -90.99 92.01 8.57 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.014 -1.106 . . . . 25.0 108.014 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -110.77 117.42 33.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.994 -1.484 . . . . 25.0 106.994 175.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.18 82.72 0.35 Allowed Glycine 0 CA--C 1.501 -0.819 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.717 -170.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 122.64 13.19 4.74 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 120.98 -0.628 . . . . 25.0 113.812 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.28 104.04 5.69 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.7 mt -74.76 122.83 88.35 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.51 156.8 49.61 Favored 'Trans proline' 0 C--N 1.345 0.389 0 N-CA-C 114.503 0.924 . . . . 25.0 114.503 -176.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -99.14 29.39 3.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 73.56 -15.89 0.53 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.881 1.673 . . . . 25.0 112.601 -176.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -130.55 148.97 52.41 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.5 t -142.48 94.96 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 106.996 -1.483 . . . . 25.0 106.996 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.1 t -88.71 136.89 32.77 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.9 166.94 23.27 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 106.12 -1.807 . . . . 25.0 106.12 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -133.46 152.87 51.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.415 -2.069 . . . . 25.0 105.415 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.65 159.54 33.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.795 -1.187 . . . . 25.0 107.795 -178.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -105.29 115.52 30.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.737 0.273 . . . . 25.0 111.737 -175.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.79 132.6 64.03 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 108.753 -0.832 . . . . 25.0 108.753 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -61.66 146.81 96.51 Favored 'Trans proline' 0 C--N 1.354 0.864 0 N-CA-C 113.682 0.609 . . . . 25.0 113.682 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.448 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.57 -29.56 41.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.98 -168.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -81.88 7.07 13.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.584 -0.735 . . . . 25.0 110.594 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.1 mmt-85 -114.03 51.9 0.85 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.027 -1.101 . . . . 25.0 108.027 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.09 170.96 11.73 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.557 -1.645 . . . . 25.0 106.557 175.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 86.89 -167.37 38.17 Favored Glycine 0 C--N 1.321 -0.263 0 N-CA-C 116.213 1.245 . . . . 25.0 116.213 176.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.4 t -86.03 106.91 17.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.41 0.624 . . . . 25.0 110.985 -168.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -158.2 171.25 20.54 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.907 -0.588 . . . . 25.0 111.623 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -105.7 150.22 8.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 64.2 mt -131.94 122.84 50.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -106.88 132.96 52.24 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.192 -0.913 . . . . 25.0 109.998 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.4 137.73 54.43 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 122.905 0.482 . . . . 25.0 109.76 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.6 p -128.8 138.0 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 114.04 1.126 . . . . 25.0 114.04 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.408 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.3 t90 -98.44 121.6 40.59 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 105.086 -2.191 . . . . 25.0 105.086 170.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -106.17 119.35 39.01 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.815 -1.18 . . . . 25.0 107.815 -176.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 22.2 mm -84.71 137.97 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 122.031 -0.418 . . . . 25.0 112.092 -171.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -77.9 -45.12 25.01 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.57 -0.706 . . . . 25.0 111.094 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.22 -25.9 65.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.697 1.369 . . . . 25.0 114.697 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 69.6 p -139.31 165.9 25.96 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.444 0.64 . . . . 25.0 109.607 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.62 29.84 0.25 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.555 -0.748 . . . . 25.0 112.642 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -99.05 147.94 24.53 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -177.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.32 144.94 12.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 171.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -146.75 130.62 17.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.996 0.369 . . . . 25.0 111.996 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -91.7 118.08 30.34 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.527 0.517 . . . . 25.0 110.776 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -97.17 116.74 29.93 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.875 -1.158 . . . . 25.0 107.875 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.82 140.16 29.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.951 -0.568 . . . . 25.0 112.117 -176.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -126.93 134.31 66.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 105.945 -1.872 . . . . 25.0 105.945 167.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -94.08 130.43 40.24 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 176.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.1 m -132.06 162.8 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 113.08 0.77 . . . . 25.0 113.08 -174.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -118.06 95.11 4.76 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.78 163.9 14.29 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.008 -0.542 . . . . 25.0 112.109 -172.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 63.3 p -143.83 151.82 40.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.686 -0.487 . . . . 25.0 109.686 175.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 117.791 -1.099 . . . . 25.0 112.345 -176.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.496 0.665 . . . . 25.0 110.389 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 170.61 36.62 Favored Glycine 0 CA--C 1.508 -0.395 1 N-CA-C 101.375 -4.69 . . . . 25.0 101.375 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -147.85 164.78 32.6 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 120.402 2.101 . . . . 25.0 110.336 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -101.03 122.3 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 107.639 -1.245 . . . . 25.0 107.639 176.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.61 -42.36 61.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.72 -1.127 . . . . 25.0 109.974 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 t -153.34 129.5 5.36 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 164' ' ' ILE . 68.0 Cg_endo -64.76 133.81 17.78 Favored 'Cis proline' 0 CA--C 1.533 0.464 0 C-N-CA 128.791 0.746 . . . . 25.0 111.103 -0.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 110.49 3.21 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.576 0.584 . . . . 25.0 112.576 -172.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.2 t -71.94 157.17 38.33 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.2 mtp180 -55.42 -24.98 33.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.478 0.711 . . . . 25.0 112.272 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.76 -53.99 38.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.826 0.822 . . . . 25.0 109.539 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -68.26 -33.06 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.501 -0.772 . . . . 25.0 110.818 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.9 -33.17 74.74 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 122.009 -0.432 . . . . 25.0 110.449 177.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -65.59 -38.99 91.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.72 -0.474 . . . . 25.0 109.72 178.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -64.48 -36.75 85.21 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.202 0.525 . . . . 25.0 110.263 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -78.22 5.8 9.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.037 -0.528 . . . . 25.0 111.473 177.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 58.73 25.74 13.78 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.137 1.375 . . . . 25.0 112.751 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.482 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.1 mt -91.78 -18.88 23.22 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.482 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -122.35 158.25 30.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 177.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.9 p -133.93 175.23 9.65 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 122.866 0.466 . . . . 25.0 109.956 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 68.12 5.29 4.55 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.848 1.796 . . . . 25.0 115.848 175.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.1 m -68.66 -35.37 77.15 Favored 'General case' 0 CA--C 1.504 -0.811 0 O-C-N 121.601 -0.687 . . . . 25.0 112.025 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.42 -62.96 1.83 Allowed Glycine 0 C--O 1.22 -0.743 0 O-C-N 123.813 0.695 . . . . 25.0 111.804 -177.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -88.01 -50.1 6.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 114.74 1.385 . . . . 25.0 114.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 25' ' ' VAL . 2.1 t -65.08 -13.07 14.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 114.549 -1.205 . . . . 25.0 114.146 -165.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -82.59 -9.97 59.17 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.24 -0.984 . . . . 25.0 111.563 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -105.99 -34.09 7.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.266 -0.574 . . . . 25.0 109.479 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -127.1 98.9 29.29 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.638 -0.255 . . . . 25.0 111.246 172.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.16 -21.58 20.2 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 117.281 -1.346 . . . . 25.0 113.907 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -87.97 15.26 7.49 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.193 0.442 . . . . 25.0 112.193 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.8 m -61.62 -25.27 67.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.973 0.416 . . . . 25.0 111.874 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.94 117.93 5.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 115.514 1.672 . . . . 25.0 115.514 -173.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -152.95 157.28 40.36 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 105.231 -2.137 . . . . 25.0 105.231 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.76 -164.79 16.32 Favored Glycine 0 CA--C 1.51 -0.278 0 N-CA-C 108.656 -1.778 . . . . 25.0 108.656 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -118.15 149.79 40.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.432 1.116 . . . . 25.0 112.6 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.88 156.99 31.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.012 -1.107 . . . . 25.0 108.012 171.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.55 -2.77 1.77 Allowed Glycine 0 C--O 1.225 -0.459 0 CA-C-N 114.671 -1.149 . . . . 25.0 113.418 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.69 140.68 71.53 Favored Pre-proline 0 C--N 1.323 -0.571 0 O-C-N 121.518 -0.99 . . . . 25.0 110.676 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -92.84 -14.15 19.83 Favored 'Cis proline' 0 CA--C 1.543 0.937 0 C-N-CA 130.195 1.331 . . . . 25.0 115.243 -7.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -71.79 -36.87 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.193 1.553 . . . . 25.0 115.193 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.17 34.07 5.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.5 -174.62 44.64 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 114.533 -1.212 . . . . 25.0 111.717 -176.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.53 172.67 1.9 Allowed 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 123.663 2.909 . . . . 25.0 112.85 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.16 159.96 30.99 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 106.858 -1.534 . . . . 25.0 106.858 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.04 140.76 55.41 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.097 -1.446 . . . . 25.0 107.097 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.23 -6.93 77.87 Favored Glycine 0 C--O 1.23 -0.114 0 C-N-CA 121.294 -0.479 . . . . 25.0 112.958 -174.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -124.89 9.68 8.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.376 -0.485 . . . . 25.0 109.847 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.9 mt -66.98 -50.75 61.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 122.044 -0.41 . . . . 25.0 111.405 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.06 -21.38 59.95 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.92 -0.488 . . . . 25.0 109.839 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.6 p -82.66 -9.46 59.37 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.844 -0.343 . . . . 25.0 111.821 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.29 37.61 19.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.721 0.808 . . . . 25.0 110.416 -172.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.6 t70 63.12 32.59 15.11 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.736 1.384 . . . . 25.0 114.736 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -118.97 134.54 55.12 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.785 -0.572 . . . . 25.0 111.973 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 p -62.82 -35.09 78.78 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 115.717 1.747 . . . . 25.0 115.717 -173.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.76 -8.03 49.33 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.254 0.549 . . . . 25.0 112.05 -178.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.688 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.0 m-85 -121.38 14.71 11.23 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 107.734 -1.21 . . . . 25.0 107.734 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -69.16 -41.14 77.63 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.108 -0.995 . . . . 25.0 111.038 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -73.87 -11.25 60.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.913 0.863 . . . . 25.0 109.675 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.688 HD13 ' HA ' ' A' ' 56' ' ' PHE . 3.0 mp -86.2 -3.43 58.97 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -114.48 -32.87 5.77 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.02 0.378 . . . . 25.0 112.02 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -97.46 120.66 38.23 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 121.477 -0.764 . . . . 25.0 110.299 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.418 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -125.83 160.97 28.46 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.316 -0.857 . . . . 25.0 109.684 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.5 p -114.99 161.19 30.53 Favored Pre-proline 0 C--N 1.318 -0.768 1 N-CA-C 99.58 -4.23 . . . . 25.0 99.58 160.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.57 -2.64 10.39 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 116.823 -1.651 . . . . 25.0 116.127 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -126.1 11.49 7.63 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.754 0.787 . . . . 25.0 111.282 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -79.59 -29.86 41.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.276 -0.89 . . . . 25.0 112.969 -176.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.418 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.1 m95 -125.6 167.01 15.68 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 110.022 -0.362 . . . . 25.0 110.022 -177.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -68.2 125.7 27.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 172.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -99.22 106.12 18.24 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 100.202 -3.999 . . . . 25.0 100.202 176.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.85 135.12 52.03 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.175 -0.92 . . . . 25.0 110.495 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -89.77 100.68 13.44 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.848 -1.167 . . . . 25.0 107.848 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.3 mt -131.28 174.03 10.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.244 -1.021 . . . . 25.0 108.244 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.67 155.6 24.19 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.478 -0.783 . . . . 25.0 111.666 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 54.2 p -77.28 167.21 22.1 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 172.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.97 -162.08 22.87 Favored Glycine 0 C--O 1.241 0.553 0 N-CA-C 110.712 -0.955 . . . . 25.0 110.712 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 133.87 56.65 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 118.958 1.379 . . . . 25.0 114.043 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.42 159.54 41.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.45 -1.685 . . . . 25.0 106.45 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.8 p -106.12 152.97 22.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 106.923 -1.51 . . . . 25.0 106.923 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -138.28 101.06 4.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 105.238 -2.134 . . . . 25.0 105.238 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.1 107.78 20.34 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.865 0.84 . . . . 25.0 110.114 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -97.21 146.47 25.06 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.426 -0.806 . . . . 25.0 110.074 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -124.89 112.11 16.24 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.67 108.5 17.98 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.437 -0.801 . . . . 25.0 111.225 -172.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -71.69 -32.73 68.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.443 0.639 . . . . 25.0 109.861 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.49 117.56 23.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.495 -0.557 . . . . 25.0 109.495 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -72.64 -5.73 39.46 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.654 1.353 . . . . 25.0 114.654 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.94 156.61 23.96 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -72.87 156.03 39.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 113.762 1.023 . . . . 25.0 113.762 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 12.4 t -99.96 157.67 16.37 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.527 -0.916 . . . . 25.0 108.527 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -118.12 -14.7 9.91 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.117 0.261 . . . . 25.0 111.617 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.7 t -172.58 152.66 2.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.849 0.356 . . . . 25.0 111.51 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 51.5 m95 -122.92 138.91 54.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 104.599 -2.371 . . . . 25.0 104.599 167.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -143.49 147.03 33.9 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -136.15 132.86 36.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.169 -1.789 . . . . 25.0 106.169 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.83 161.8 41.1 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.446 0.566 . . . . 25.0 110.197 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.29 165.96 30.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 113.427 0.899 . . . . 25.0 113.427 -167.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 17.0 p -80.36 160.3 25.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.49 -1.3 . . . . 25.0 107.49 169.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -61.89 159.41 36.3 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.29 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 -24.36 34.51 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 116.256 -2.029 . . . . 25.0 114.234 -173.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -114.43 32.05 6.21 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.398 . . . . 25.0 111.358 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -74.15 166.99 22.46 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.952 0.882 . . . . 25.0 112.87 -176.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -83.0 100.99 10.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.683 -1.144 . . . . 25.0 110.031 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.31 15.46 10.47 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 116.421 2.008 . . . . 25.0 116.421 -169.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.7 t -124.29 9.03 8.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.814 -0.81 . . . . 25.0 108.814 175.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -112.52 158.44 37.35 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 114.544 -1.207 . . . . 25.0 108.077 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.82 154.61 71.96 Favored 'Trans proline' 0 C--N 1.347 0.481 0 O-C-N 121.863 0.401 . . . . 25.0 111.953 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.05 105.14 3.8 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.364 0.602 . . . . 25.0 111.046 -177.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.6 p -94.04 154.43 17.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -63.59 -26.58 68.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.035 -0.415 . . . . 25.0 111.639 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.07 62.65 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.714 177.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.0 t -76.73 -20.79 56.13 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.627 0.727 . . . . 25.0 111.305 -178.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.421 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 55.8 m-85 -88.21 154.95 20.02 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 115.134 1.531 . . . . 25.0 115.134 -176.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -92.3 95.85 9.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 102.301 -3.222 . . . . 25.0 102.301 161.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 79.9 mt -66.96 -6.85 18.42 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.77 1.396 . . . . 25.0 114.77 -169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.0 t -85.97 130.35 50.71 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.314 -0.995 . . . . 25.0 108.314 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.93 148.99 52.55 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 115.509 -2.528 . . . . 25.0 111.457 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -100.07 -9.1 22.99 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.123 0.487 . . . . 25.0 111.266 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.0 m -149.23 69.48 1.06 Allowed 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.943 -0.571 . . . . 25.0 109.561 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -88.99 134.58 33.93 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.566 -0.854 . . . . 25.0 109.185 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.51 99.04 5.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 105.849 -1.908 . . . . 25.0 105.849 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -91.98 92.08 8.14 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -105.14 118.34 36.28 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 106.796 -1.557 . . . . 25.0 106.796 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.27 79.9 0.47 Allowed Glycine 0 CA--C 1.502 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 114.082 -167.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.84 22.44 6.63 Favored Glycine 0 C--N 1.32 -0.361 0 C-N-CA 120.861 -0.685 . . . . 25.0 112.61 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.27 105.68 5.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.415 0.626 . . . . 25.0 109.343 177.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.49 122.78 87.56 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 105.596 -2.001 . . . . 25.0 105.596 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.73 168.11 24.19 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 117.714 -1.057 . . . . 25.0 113.872 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.99 24.29 4.36 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.693 -0.855 . . . . 25.0 108.693 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.83 -17.97 0.28 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.843 1.657 . . . . 25.0 112.602 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -129.06 148.04 50.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 104.028 -2.582 . . . . 25.0 104.028 170.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.86 94.95 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.049 -1.463 . . . . 25.0 107.049 -178.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.4 m -85.71 100.06 11.74 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 107.894 -1.15 . . . . 25.0 107.894 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.08 166.53 11.55 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.303 -1.369 . . . . 25.0 107.303 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -134.64 153.58 51.91 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 170.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -164.38 160.59 20.93 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.922 -1.14 . . . . 25.0 107.922 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -105.21 117.26 33.56 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.172 0.295 . . . . 25.0 110.948 -176.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.14 130.95 67.77 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 107.924 -1.139 . . . . 25.0 107.924 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -62.2 147.31 95.26 Favored 'Trans proline' 0 C--N 1.353 0.793 0 CA-C-O 121.682 0.617 . . . . 25.0 113.402 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.418 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.11 -25.65 36.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.222 -0.899 . . . . 25.0 112.653 -169.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 p-10 -83.76 9.4 11.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.698 0.761 . . . . 25.0 110.225 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -115.13 53.3 0.83 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.189 -1.041 . . . . 25.0 108.189 171.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 32.3 p -86.11 166.69 15.6 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 106.414 -1.699 . . . . 25.0 106.414 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.16 -166.76 35.41 Favored Glycine 0 C--N 1.319 -0.384 0 N-CA-C 115.459 0.944 . . . . 25.0 115.459 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.01 108.31 18.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.488 0.661 . . . . 25.0 110.938 -168.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.411 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.9 p-80 -156.94 171.18 20.91 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.834 -0.621 . . . . 25.0 110.819 -176.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 p -107.8 150.6 10.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 49.8 mt -131.5 120.1 44.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.489 -2.041 . . . . 25.0 105.489 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.56 132.73 51.36 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.04 135.1 50.33 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.993 -0.373 . . . . 25.0 109.993 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.7 p -122.01 144.2 32.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 122.075 0.941 . . . . 25.0 112.572 -177.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.6 t90 -112.48 105.62 13.9 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.173 -2.158 . . . . 25.0 105.173 173.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.17 127.37 35.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.569 -1.271 . . . . 25.0 107.569 179.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.0 mm -83.62 140.68 15.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.768 -0.456 . . . . 25.0 109.768 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.38 -42.78 24.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.353 0.597 . . . . 25.0 110.477 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.13 -24.62 65.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.734 1.012 . . . . 25.0 113.734 -172.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.6 p -139.49 171.21 14.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.999 0.904 . . . . 25.0 110.206 -174.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.6 20.21 0.74 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.239 -0.891 . . . . 25.0 112.209 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -90.1 146.48 24.28 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.057 0.762 . . . . 25.0 113.057 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.06 144.61 11.48 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -147.95 127.19 12.98 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -84.34 117.13 23.4 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.04 0.448 . . . . 25.0 110.732 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -97.1 112.53 24.26 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.81 141.02 29.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.432 -0.804 . . . . 25.0 111.869 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.6 tt -125.15 134.87 65.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 105.607 -1.997 . . . . 25.0 105.607 166.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -93.65 131.25 39.14 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.885 -1.524 . . . . 25.0 106.885 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.4 m -132.5 161.24 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.652 0.612 . . . . 25.0 112.652 -175.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.68 95.05 4.68 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 103.729 -2.693 . . . . 25.0 103.729 167.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.4 tp -90.4 163.18 14.78 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 112.558 0.577 . . . . 25.0 112.558 -171.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 74.9 p -145.88 164.09 33.04 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.493 -0.929 . . . . 25.0 108.493 177.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.069 -0.967 . . . . 25.0 110.515 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.0 m80 . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.356 0.598 . . . . 25.0 110.473 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.22 169.58 35.84 Favored Glycine 0 C--N 1.32 -0.348 1 N-CA-C 101.077 -4.809 . . . . 25.0 101.077 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.469 ' HA ' HE22 ' A' ' 162' ' ' GLN . 36.7 p90 -143.97 165.71 27.0 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 120.124 1.962 . . . . 25.0 110.2 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -102.46 121.23 53.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 106.17 -1.789 . . . . 25.0 106.17 176.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -74.04 -41.43 61.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.53 -1.213 . . . . 25.0 109.553 -174.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -154.17 129.22 4.97 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 105.987 -1.857 . . . . 25.0 105.987 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -65.28 131.56 13.29 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 128.828 0.761 . . . . 25.0 111.543 -0.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 113.15 4.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.996 -0.547 . . . . 25.0 111.594 -173.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.4 p -72.13 163.71 27.44 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.273 -0.639 . . . . 25.0 109.273 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -59.73 -21.86 61.25 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.146 0.498 . . . . 25.0 111.797 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.28 -53.68 27.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.934 -0.765 . . . . 25.0 108.934 174.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.01 -35.81 81.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.684 -0.689 . . . . 25.0 110.759 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.41 -32.62 74.32 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.13 -0.356 . . . . 25.0 111.024 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 25.0 109.839 177.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -66.77 -36.09 81.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.141 0.496 . . . . 25.0 109.864 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.97 3.61 11.84 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.357 -0.383 . . . . 25.0 111.964 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 58.53 21.84 9.03 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.094 1.357 . . . . 25.0 112.836 -178.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.471 ' C ' HD22 ' A' ' 19' ' ' ASN . 95.5 mt -84.72 -21.17 30.19 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.284 -1.376 . . . . 25.0 107.284 173.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.471 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -123.19 157.73 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 104.736 -2.32 . . . . 25.0 104.736 176.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 p -135.26 176.67 8.46 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.575 -0.528 . . . . 25.0 109.575 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 69.83 5.05 5.04 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.536 1.68 . . . . 25.0 115.536 174.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -68.06 -38.84 82.91 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 121.402 -0.811 . . . . 25.0 110.844 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.32 -63.81 1.74 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.683 0.614 . . . . 25.0 112.037 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -87.97 -52.45 5.26 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 122.503 1.144 . . . . 25.0 111.889 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.469 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.8 OUTLIER -67.86 -11.82 14.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.469 -1.241 . . . . 25.0 113.248 -171.83 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -85.6 -1.44 57.13 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 121.739 -0.601 . . . . 25.0 111.487 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.41 -34.08 4.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.056 -0.657 . . . . 25.0 110.349 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -127.04 95.79 35.99 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 120.7 0.286 . . . . 25.0 110.349 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' HG12 ' A' ' 25' ' ' VAL . 82.7 Cg_endo -70.63 -19.39 32.04 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 115.05 1.134 . . . . 25.0 115.05 -177.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -87.02 10.92 14.96 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.772 -0.58 . . . . 25.0 112.404 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.9 m -62.52 -18.29 61.64 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.559 0.577 . . . . 25.0 112.559 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.1 m -64.13 122.35 14.86 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 114.875 1.435 . . . . 25.0 114.875 -175.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -153.04 155.23 36.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.601 -1.629 . . . . 25.0 106.601 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.62 -167.09 19.77 Favored Glycine 0 CA--C 1.512 -0.123 0 N-CA-C 107.838 -2.105 . . . . 25.0 107.838 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 tp -117.93 149.77 40.35 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.536 1.168 . . . . 25.0 111.891 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -65.02 156.93 29.81 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.36 -1.348 . . . . 25.0 107.36 171.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.89 4.57 2.98 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-N 114.848 -1.069 . . . . 25.0 113.73 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -75.99 143.22 73.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 121.528 -0.983 . . . . 25.0 109.263 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.22 -16.93 17.24 Favored 'Cis proline' 0 CA--C 1.543 0.934 0 N-CA-C 115.635 1.36 . . . . 25.0 115.635 -5.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -70.85 -37.75 73.15 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.95 1.463 . . . . 25.0 114.95 -169.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -113.26 28.47 8.76 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.067 -1.827 . . . . 25.0 106.067 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.09 -176.43 45.06 Favored Glycine 0 N--CA 1.445 -0.702 0 CA-C-N 114.567 -1.197 . . . . 25.0 110.692 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.59 175.17 1.77 Allowed 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 123.781 2.987 . . . . 25.0 113.222 177.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.04 160.03 31.01 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.683 -1.599 . . . . 25.0 106.683 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.25 140.07 57.23 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 175.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.33 -5.9 83.26 Favored Glycine 0 C--O 1.229 -0.212 0 CA-C-O 121.349 0.416 . . . . 25.0 112.785 -174.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 60.1 m170 -125.76 8.88 7.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.453 -0.44 . . . . 25.0 110.962 178.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.8 mt -64.52 -46.8 91.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 121.915 -0.491 . . . . 25.0 110.968 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.39 -12.09 59.98 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.078 -0.389 . . . . 25.0 110.482 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 p -94.0 -7.58 42.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.01 33.97 12.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.555 0.742 . . . . 25.0 110.758 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 61.38 32.55 19.06 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.339 1.237 . . . . 25.0 114.339 -178.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -118.46 137.61 53.05 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.124 0.488 . . . . 25.0 111.608 176.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.85 -34.88 78.27 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 115.233 1.568 . . . . 25.0 115.233 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.5 t -71.46 -7.41 47.26 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.27 0.557 . . . . 25.0 112.468 -177.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.682 ' HA ' HD13 ' A' ' 59' ' ' LEU . 16.3 m-85 -120.37 12.5 11.69 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 107.161 -1.422 . . . . 25.0 107.161 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -72.12 -35.08 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.081 -1.012 . . . . 25.0 110.171 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mp0 -70.08 -16.56 63.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.897 0.856 . . . . 25.0 109.864 175.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.682 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.3 mp -87.42 -5.93 58.64 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 -176.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -114.14 -31.96 6.16 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 112.384 0.513 . . . . 25.0 112.384 174.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -95.1 118.15 31.41 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.539 -0.726 . . . . 25.0 110.342 -178.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.436 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -126.38 161.01 28.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.109 -0.701 . . . . 25.0 109.109 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.1 p -118.81 161.6 35.28 Favored Pre-proline 0 C--N 1.317 -0.813 0 N-CA-C 100.245 -3.983 . . . . 25.0 100.245 162.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.4 -5.09 15.13 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 116.728 -1.715 . . . . 25.0 115.588 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.4 t -123.66 10.03 9.0 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.063 0.459 . . . . 25.0 111.71 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -79.07 -30.46 43.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.724 0.638 . . . . 25.0 112.724 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.436 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 14.5 m95 -123.51 165.78 16.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 120.698 0.285 . . . . 25.0 110.516 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -67.72 129.17 39.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 105.471 -2.048 . . . . 25.0 105.471 169.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -100.15 105.84 17.49 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 101.249 -3.612 . . . . 25.0 101.249 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.75 135.79 54.51 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.819 -1.082 . . . . 25.0 109.93 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -93.43 106.17 18.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.826 -1.079 . . . . 25.0 109.091 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -131.64 173.71 10.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.655 -1.239 . . . . 25.0 107.655 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.73 157.34 23.32 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.727 -0.669 . . . . 25.0 110.421 -176.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.454 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.8 p -77.28 166.76 22.77 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.921 -1.511 . . . . 25.0 106.921 173.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.52 -161.78 23.18 Favored Glycine 0 C--O 1.241 0.539 0 N-CA-C 110.336 -1.106 . . . . 25.0 110.336 -177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.23 132.54 47.33 Favored 'Trans proline' 0 C--N 1.346 0.408 0 CA-C-N 119.147 1.473 . . . . 25.0 114.288 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -138.93 161.31 37.64 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.1 p -103.43 150.91 23.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -138.15 100.92 4.27 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.467 -2.049 . . . . 25.0 105.467 -178.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.78 116.13 31.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 122.041 0.924 . . . . 25.0 110.023 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -100.48 149.2 23.93 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.151 -0.931 . . . . 25.0 109.85 178.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -127.92 115.05 17.96 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.494 -2.409 . . . . 25.0 104.494 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -114.37 121.93 45.13 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.101 -0.954 . . . . 25.0 110.791 -172.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.4 t -74.48 -29.72 61.55 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.51 0.671 . . . . 25.0 110.141 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.62 133.38 35.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.03 0.443 . . . . 25.0 110.856 -177.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -77.92 -5.77 52.18 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.748 0.648 . . . . 25.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -63.97 156.86 26.6 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.353 0.872 . . . . 25.0 113.353 -175.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.4 t -77.63 155.97 31.08 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.561 1.319 . . . . 25.0 114.561 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -103.67 156.23 17.95 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.024 -0.535 . . . . 25.0 109.711 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -118.03 -14.81 9.96 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.227 0.454 . . . . 25.0 112.227 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.4 t -172.54 154.1 3.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.976 0.417 . . . . 25.0 111.525 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.3 m95 -128.06 134.73 49.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.83 -2.285 . . . . 25.0 104.83 168.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -141.0 149.61 41.99 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.373 -0.973 . . . . 25.0 108.373 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -137.95 135.29 35.89 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 105.731 -1.951 . . . . 25.0 105.731 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.98 160.9 42.88 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.183 0.447 . . . . 25.0 109.938 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.35 166.5 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 112.736 0.643 . . . . 25.0 112.736 -167.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 p -79.6 158.7 27.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -62.32 158.91 44.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.109 -0.95 . . . . 25.0 109.859 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.52 -15.64 38.11 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 117.894 -0.937 . . . . 25.0 114.179 -174.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -118.66 32.06 6.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.721 0.408 . . . . 25.0 111.882 -176.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.52 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -79.14 161.58 26.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.819 0.819 . . . . 25.0 112.076 -177.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -83.11 101.03 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.703 -1.135 . . . . 25.0 110.098 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.52 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -83.98 16.68 2.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 116.928 2.195 . . . . 25.0 116.928 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -123.87 5.16 8.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.587 0.708 . . . . 25.0 109.179 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -108.71 157.45 36.68 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 114.838 -1.074 . . . . 25.0 108.499 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.71 154.9 70.08 Favored 'Trans proline' 0 C--N 1.346 0.415 0 O-C-N 121.968 0.457 . . . . 25.0 112.695 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.26 112.25 9.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.321 0.581 . . . . 25.0 110.945 -177.028 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.8 p -104.7 156.8 17.66 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -63.82 -27.04 68.9 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 122.087 -0.383 . . . . 25.0 111.735 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -25.16 61.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.91 -0.586 . . . . 25.0 112.075 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.2 t -78.29 -20.43 51.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.177 0.513 . . . . 25.0 111.149 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -89.78 153.86 20.36 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 115.077 1.51 . . . . 25.0 115.077 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -90.8 97.93 11.47 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 103.133 -2.914 . . . . 25.0 103.133 162.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -67.46 -5.87 16.86 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.82 1.415 . . . . 25.0 114.82 -170.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -88.44 128.64 52.27 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.206 -1.035 . . . . 25.0 108.206 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.04 145.73 50.5 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.325 -2.65 . . . . 25.0 111.422 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -95.17 -9.13 34.32 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.916 0.389 . . . . 25.0 111.788 -177.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 55.6 m -151.39 69.35 0.94 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.082 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.15 133.57 34.35 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 118.775 -1.17 . . . . 25.0 109.858 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.36 99.06 6.27 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -93.26 92.07 7.54 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 107.229 -1.397 . . . . 25.0 107.229 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -108.81 118.36 36.6 Favored 'General case' 0 C--O 1.216 -0.675 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 178.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -93.61 76.63 1.09 Allowed Glycine 0 CA--C 1.503 -0.705 0 CA-C-N 115.434 -0.803 . . . . 25.0 114.772 -168.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 105.11 25.34 6.79 Favored Glycine 0 C--N 1.319 -0.388 0 C-N-CA 121.011 -0.614 . . . . 25.0 113.122 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.89 106.35 3.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.649 0.738 . . . . 25.0 109.724 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.05 123.72 88.8 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 106.712 -1.588 . . . . 25.0 106.712 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.33 172.41 15.4 Favored 'Trans proline' 0 C--N 1.344 0.327 0 N-CA-C 113.887 0.687 . . . . 25.0 113.887 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.407 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -99.53 27.68 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.017 -1.105 . . . . 25.0 108.017 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.24 -9.84 0.58 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.622 1.569 . . . . 25.0 112.129 -173.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' A' ' 128' ' ' ALA . 60.8 mt-30 -131.48 151.65 51.39 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 103.849 -2.649 . . . . 25.0 103.849 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -142.1 95.18 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 106.924 -1.51 . . . . 25.0 106.924 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.5 t -94.37 126.88 39.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 107.179 -1.415 . . . . 25.0 107.179 175.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -133.17 166.92 21.33 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 105.299 -2.111 . . . . 25.0 105.299 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -131.33 151.07 51.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 173.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.07 158.95 37.39 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.791 -1.189 . . . . 25.0 107.791 -177.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -102.21 116.17 32.1 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.091 0.245 . . . . 25.0 111.15 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.8 mt -76.91 131.26 73.65 Favored Pre-proline 0 C--O 1.241 0.606 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.37 146.41 97.26 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-O 121.655 0.606 . . . . 25.0 113.527 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.01 -26.24 36.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.186 -0.915 . . . . 25.0 112.588 -168.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -84.31 10.78 9.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 25.0 110.172 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.5 mmt-85 -116.15 50.65 1.02 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.45 -0.944 . . . . 25.0 108.45 171.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.0 p -85.86 164.63 17.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.491 -1.3 . . . . 25.0 107.491 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.69 -166.91 31.81 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 114.648 0.619 . . . . 25.0 114.648 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.3 t -86.02 112.43 21.22 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.353 0.596 . . . . 25.0 110.354 -169.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -159.46 172.27 18.2 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.711 -0.677 . . . . 25.0 110.317 -176.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.07 151.69 10.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.3 mt -133.13 122.32 45.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 104.895 -2.261 . . . . 25.0 104.895 -178.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.41 134.55 50.3 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.557 -0.747 . . . . 25.0 109.919 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -125.12 134.44 52.45 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.791 0.436 . . . . 25.0 110.078 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.21 142.91 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 122.322 1.058 . . . . 25.0 112.438 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -111.49 114.58 27.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 105.737 -1.949 . . . . 25.0 105.737 173.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -94.69 122.31 37.16 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.842 -1.17 . . . . 25.0 107.842 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.5 mm -78.69 142.42 14.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.543 -0.54 . . . . 25.0 109.543 -177.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.54 -42.94 21.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.924 0.784 . . . . 25.0 110.108 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -23.89 64.79 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.649 0.981 . . . . 25.0 113.649 -172.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.3 p -139.09 168.61 19.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.901 0.858 . . . . 25.0 109.988 -175.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.24 21.39 0.75 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.285 -0.871 . . . . 25.0 112.334 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -90.7 147.27 23.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.35 143.41 11.94 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 105.916 -1.883 . . . . 25.0 105.916 173.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -148.07 128.54 14.02 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.72 0.267 . . . . 25.0 111.72 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -86.96 117.76 25.9 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 120.74 0.305 . . . . 25.0 110.859 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . 0.469 HE22 ' HA ' ' A' ' 3' ' ' TYR . 78.0 mt-30 -97.24 118.7 34.27 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 176.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -87.89 142.5 27.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.713 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.85 134.85 65.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 105.298 -2.112 . . . . 25.0 105.298 166.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.71 129.54 42.89 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 177.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -132.97 162.11 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 113.454 0.909 . . . . 25.0 113.454 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -117.89 95.11 4.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 104.56 -2.385 . . . . 25.0 104.56 168.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.14 163.66 14.76 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 112.397 0.517 . . . . 25.0 112.397 -173.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.3 p -145.74 162.95 36.42 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.896 -1.15 . . . . 25.0 107.896 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 117.96 -1.019 . . . . 25.0 110.879 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 21.5 m80 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 121.341 0.591 . . . . 25.0 110.602 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.43 164.46 30.52 Favored Glycine 0 C--N 1.321 -0.262 1 N-CA-C 99.904 -5.278 . . . . 25.0 99.904 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -145.6 162.03 38.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.968 2.384 . . . . 25.0 111.625 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.01 121.62 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 107.95 -1.129 . . . . 25.0 107.95 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -76.02 -42.78 46.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.456 -1.247 . . . . 25.0 109.809 -175.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.2 t -152.86 128.83 5.19 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 106.154 -1.795 . . . . 25.0 106.154 177.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.99 131.74 11.89 Favored 'Cis proline' 0 CA--C 1.534 0.483 0 C-N-CA 128.771 0.738 . . . . 25.0 111.193 -0.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.44 112.61 4.15 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 25.0 112.242 -171.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.9 t -71.97 157.82 37.12 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.378 -0.971 . . . . 25.0 108.378 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -56.12 -24.24 39.46 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.478 0.711 . . . . 25.0 111.826 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.7 -53.09 37.33 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.736 0.779 . . . . 25.0 109.337 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -66.86 -36.72 82.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.599 -0.728 . . . . 25.0 110.482 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -63.38 -31.02 72.07 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.985 -0.286 . . . . 25.0 110.755 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -40.63 95.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.192 0.52 . . . . 25.0 110.276 178.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.485 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.4 tmtm? -70.19 -33.55 71.86 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.04 0.448 . . . . 25.0 110.09 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -76.14 2.53 12.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.385 -0.37 . . . . 25.0 111.488 174.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 58.1 22.78 9.37 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.353 1.461 . . . . 25.0 113.093 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.465 ' C ' HD22 ' A' ' 19' ' ' ASN . 94.8 mt -85.83 -21.86 27.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.148 -1.427 . . . . 25.0 107.148 173.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.465 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.89 159.08 30.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.9 p -136.72 175.96 9.14 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.881 -0.414 . . . . 25.0 109.881 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 72.62 5.22 5.19 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.523 1.675 . . . . 25.0 115.523 173.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -67.77 -36.51 80.62 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.671 -0.643 . . . . 25.0 111.282 173.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -63.25 1.67 Allowed Glycine 0 C--O 1.218 -0.858 0 O-C-N 123.552 0.532 . . . . 25.0 112.241 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -88.09 -53.86 4.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.5 1.143 . . . . 25.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.75 -7.15 7.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.401 -171.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.73 3.16 51.82 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.844 -0.535 . . . . 25.0 111.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -119.77 -33.99 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.272 -0.571 . . . . 25.0 110.911 173.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.98 107.46 22.07 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 107.746 -1.205 . . . . 25.0 107.746 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.485 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.7 Cg_endo -73.05 -19.23 23.24 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 116.276 -2.016 . . . . 25.0 114.389 -175.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -85.92 9.37 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.356 0.502 . . . . 25.0 112.356 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -61.4 -18.29 58.15 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.814 0.672 . . . . 25.0 112.814 178.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.4 m -65.29 124.21 19.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 114.721 1.378 . . . . 25.0 114.721 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -152.97 158.8 42.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.303 -1.74 . . . . 25.0 106.303 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.84 -166.57 18.99 Favored Glycine 0 N--CA 1.453 -0.172 0 N-CA-C 107.395 -2.282 . . . . 25.0 107.395 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.79 149.52 43.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 118.487 1.144 . . . . 25.0 112.31 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -67.03 156.93 34.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 107.126 -1.435 . . . . 25.0 107.126 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.18 -5.41 1.9 Allowed Glycine 0 C--N 1.318 -0.457 0 CA-C-N 114.953 -1.022 . . . . 25.0 112.394 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -75.97 145.85 78.15 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.25 -1.018 . . . . 25.0 108.25 -178.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -90.08 -19.99 13.05 Favored 'Cis proline' 0 CA--C 1.542 0.883 0 N-CA-C 115.859 1.446 . . . . 25.0 115.859 -4.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -71.08 -35.61 71.93 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.576 1.324 . . . . 25.0 114.576 -169.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.69 35.98 4.19 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.64 -1.985 . . . . 25.0 105.64 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -85.45 175.69 49.51 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.735 -1.121 . . . . 25.0 110.941 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.39 172.93 3.81 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 123.134 2.556 . . . . 25.0 113.616 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.0 30.99 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.203 -1.777 . . . . 25.0 106.203 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.71 139.56 57.83 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.504 -1.225 . . . . 25.0 107.725 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 -4.98 84.88 Favored Glycine 0 C--O 1.227 -0.316 0 C-N-CA 121.279 -0.486 . . . . 25.0 113.125 -174.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 55.1 m170 -124.82 10.28 8.3 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.349 -0.5 . . . . 25.0 109.816 177.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.1 mt -66.25 -45.27 90.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.31 -0.244 . . . . 25.0 110.903 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.44 -27.61 60.68 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.546 -0.539 . . . . 25.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.3 p -79.93 -7.66 58.89 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.459 0.911 . . . . 25.0 113.459 -176.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 35.53 18.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.582 0.753 . . . . 25.0 110.294 -173.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.8 OUTLIER 62.42 30.34 17.29 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.646 1.35 . . . . 25.0 114.646 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -117.51 137.33 52.62 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.828 -0.545 . . . . 25.0 111.992 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.99 -35.89 81.73 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 115.585 1.698 . . . . 25.0 115.585 -173.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.3 t -71.31 -4.87 28.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.522 0.564 . . . . 25.0 112.522 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.708 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.0 m-85 -123.39 11.9 9.36 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -73.57 -34.79 65.31 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.152 -0.968 . . . . 25.0 109.813 -176.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -71.61 -14.06 61.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.871 0.843 . . . . 25.0 109.419 175.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.708 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -90.46 -2.26 57.93 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.43 -32.19 6.0 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.312 0.577 . . . . 25.0 110.969 173.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.8 115.03 24.97 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 121.773 -0.579 . . . . 25.0 110.193 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -127.62 160.92 30.13 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.129 0.49 . . . . 25.0 110.027 176.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 33.0 p -119.87 162.45 33.03 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 100.384 -3.932 . . . . 25.0 100.384 162.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -70.12 -3.44 12.26 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 116.32 -1.987 . . . . 25.0 115.853 -175.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -122.37 7.74 9.62 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.656 0.741 . . . . 25.0 111.529 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -76.87 -28.54 55.45 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.345 -0.847 . . . . 25.0 113.204 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.481 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.3 m95 -126.92 167.23 16.14 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.741 0.305 . . . . 25.0 111.337 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -67.77 119.92 13.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.944 -1.873 . . . . 25.0 105.944 169.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.7 mmtt -95.43 105.24 17.19 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 100.507 -3.886 . . . . 25.0 100.507 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 135.32 54.6 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.664 -1.153 . . . . 25.0 110.291 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -92.0 101.73 14.28 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.173 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.6 mt -130.23 173.94 10.29 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.207 -1.034 . . . . 25.0 108.207 -175.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.85 157.33 22.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.364 -0.835 . . . . 25.0 111.224 -175.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 68.5 p -77.36 167.82 21.06 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.854 -1.535 . . . . 25.0 106.854 173.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.75 -161.87 23.97 Favored Glycine 0 C--O 1.241 0.543 0 N-CA-C 110.856 -0.897 . . . . 25.0 110.856 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.93 133.57 54.48 Favored 'Trans proline' 0 C--N 1.345 0.346 0 CA-C-N 118.989 1.394 . . . . 25.0 114.289 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -140.46 160.26 40.38 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.168 -1.79 . . . . 25.0 106.168 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 p -104.41 152.36 22.4 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 178.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -138.34 100.99 4.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 105.618 -1.993 . . . . 25.0 105.618 -178.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.86 119.21 38.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.876 0.846 . . . . 25.0 109.006 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.6 m95 -104.63 148.0 27.02 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.031 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -127.75 107.71 10.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.97 125.09 50.87 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 123.958 0.903 . . . . 25.0 112.187 -175.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -80.46 -20.22 44.27 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.297 -1.001 . . . . 25.0 108.297 168.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.85 108.62 16.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.85 -0.614 . . . . 25.0 111.586 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -77.63 0.57 22.72 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.869 1.433 . . . . 25.0 114.869 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.6 154.33 42.15 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.057 0.389 . . . . 25.0 110.21 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.5 t -70.57 155.91 40.11 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -171.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.2 t -97.78 159.37 14.97 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.281 -1.007 . . . . 25.0 108.281 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.5 t -117.77 -16.19 10.02 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 123.145 0.278 . . . . 25.0 111.322 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.5 t -172.13 153.24 3.05 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.991 0.424 . . . . 25.0 112.112 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.88 138.29 53.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 103.837 -2.653 . . . . 25.0 103.837 167.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -142.64 147.24 35.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -135.35 133.47 38.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -147.26 163.22 37.09 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.303 -0.628 . . . . 25.0 109.303 178.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.04 164.93 32.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 114.465 1.283 . . . . 25.0 114.465 -167.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.08 158.28 26.47 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 106.934 -1.506 . . . . 25.0 106.934 168.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -63.14 158.72 53.49 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.241 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.89 -20.55 38.92 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 116.681 -1.746 . . . . 25.0 114.252 -174.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -120.55 32.05 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.552 0.575 . . . . 25.0 112.552 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.499 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -71.89 165.51 24.0 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.932 0.873 . . . . 25.0 111.558 -179.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.04 101.01 10.84 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.725 -1.125 . . . . 25.0 109.706 -179.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.499 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.16 15.21 6.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.636 2.087 . . . . 25.0 116.636 -169.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.4 t -124.17 9.24 8.61 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -113.16 156.63 42.69 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 107.465 -1.309 . . . . 25.0 107.465 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.57 156.31 66.19 Favored 'Trans proline' 0 C--N 1.345 0.343 0 O-C-N 121.918 0.431 . . . . 25.0 112.016 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.52 104.24 3.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.187 0.517 . . . . 25.0 111.395 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.3 p -92.61 159.56 15.42 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -65.69 -25.97 67.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.159 0.504 . . . . 25.0 110.719 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.58 -22.48 60.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.481 -0.782 . . . . 25.0 112.745 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 21.2 m -77.39 -12.11 59.92 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.07 0.396 . . . . 25.0 112.07 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -99.77 158.35 15.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 114.555 1.317 . . . . 25.0 114.555 -175.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -96.02 98.23 10.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 102.38 -3.193 . . . . 25.0 102.38 161.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 74.8 mt -66.86 -7.62 23.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 115.003 1.483 . . . . 25.0 115.003 -169.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -83.8 131.37 52.1 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 108.706 -0.85 . . . . 25.0 108.706 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -72.54 150.44 51.38 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 115.15 -2.767 . . . . 25.0 111.047 177.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -102.25 -11.85 18.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.399 . . . . 25.0 111.603 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 64.0 m -149.84 66.87 0.99 Allowed 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 116.234 -0.439 . . . . 25.0 110.742 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -89.06 133.47 34.34 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.078 -1.049 . . . . 25.0 109.01 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -123.78 99.07 6.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 104.833 -2.284 . . . . 25.0 104.833 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.9 92.11 8.19 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.129 -1.434 . . . . 25.0 107.129 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -105.98 118.2 36.0 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.065 -1.457 . . . . 25.0 107.065 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.99 82.45 0.37 Allowed Glycine 0 CA--C 1.501 -0.826 0 CA-C-N 115.476 -0.784 . . . . 25.0 112.609 -170.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.4 13.99 6.06 Favored Glycine 0 C--N 1.32 -0.332 0 C-N-CA 120.998 -0.62 . . . . 25.0 113.357 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.49 104.0 5.04 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.514 0.673 . . . . 25.0 109.542 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 83.6 mt -73.57 124.5 90.42 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 106.367 -1.716 . . . . 25.0 106.367 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.47 158.74 53.28 Favored 'Trans proline' 0 C--N 1.345 0.384 0 N-CA-C 113.645 0.594 . . . . 25.0 113.645 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.48 28.66 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.81 -17.92 0.33 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.962 1.705 . . . . 25.0 111.508 -173.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' A' ' 128' ' ' ALA . 50.2 mt-30 -127.68 150.8 49.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 104.668 -2.345 . . . . 25.0 104.668 169.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 46.0 t -141.02 95.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 106.764 -1.569 . . . . 25.0 106.764 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.9 t -89.65 126.88 35.8 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 107.509 -1.293 . . . . 25.0 107.509 175.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.11 166.86 20.16 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 105.443 -2.058 . . . . 25.0 105.443 177.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -136.01 152.7 51.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 104.825 -2.287 . . . . 25.0 104.825 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.69 159.35 30.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.525 -0.917 . . . . 25.0 108.525 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -103.8 115.69 30.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.391 -0.368 . . . . 25.0 110.902 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.01 131.57 72.74 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 107.891 -1.151 . . . . 25.0 107.891 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.94 147.11 95.85 Favored 'Trans proline' 0 C--N 1.354 0.861 0 CA-C-O 121.642 0.601 . . . . 25.0 113.504 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.61 -26.77 37.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.132 -0.94 . . . . 25.0 112.745 -168.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -82.67 8.45 11.99 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.565 0.698 . . . . 25.0 110.321 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -114.5 51.87 0.87 Allowed 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.816 0.817 . . . . 25.0 109.144 173.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.7 p -85.98 163.33 18.05 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 93.6 -169.28 29.95 Favored Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 115.243 0.857 . . . . 25.0 115.243 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.05 108.33 18.21 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.358 0.599 . . . . 25.0 110.86 -168.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . 0.415 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 43.1 p-80 -157.39 169.44 24.72 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.86 -0.609 . . . . 25.0 112.015 -176.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.3 148.16 10.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 N-CA-C 108.427 -0.953 . . . . 25.0 108.427 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 65.7 mt -131.03 121.21 49.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 104.776 -2.305 . . . . 25.0 104.776 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.14 130.52 53.3 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.32 -0.855 . . . . 25.0 109.963 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.16 123.9 46.65 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.043 -0.725 . . . . 25.0 109.043 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.9 p -114.11 137.78 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.952 0.882 . . . . 25.0 111.653 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -112.09 118.99 36.92 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.933 -1.506 . . . . 25.0 106.933 176.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.71 126.45 45.75 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.745 -0.835 . . . . 25.0 108.745 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.3 mm -80.84 143.05 12.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 109.071 -0.714 . . . . 25.0 109.071 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.98 -45.98 17.47 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.724 0.693 . . . . 25.0 110.212 175.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -68.13 -22.55 64.87 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.45 1.278 . . . . 25.0 114.45 -172.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -137.45 168.52 19.48 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.965 0.888 . . . . 25.0 110.084 -174.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.41 21.4 0.62 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.097 -0.956 . . . . 25.0 112.533 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -93.62 146.34 23.89 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.024 0.75 . . . . 25.0 113.024 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.34 143.62 15.18 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.088 -2.19 . . . . 25.0 105.088 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -148.51 136.05 20.53 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.958 0.725 . . . . 25.0 112.958 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -92.0 113.99 26.42 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.199 0.599 . . . . 25.0 111.598 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.1 108.67 21.45 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.056 -0.72 . . . . 25.0 109.056 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.24 142.19 30.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.596 -0.729 . . . . 25.0 112.198 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.5 136.37 61.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.264 -2.125 . . . . 25.0 105.264 166.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -97.73 130.35 44.7 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 176.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.56 162.8 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 112.74 0.645 . . . . 25.0 112.74 -174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -118.25 95.04 4.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 104.348 -2.464 . . . . 25.0 104.348 167.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -89.99 163.72 14.82 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 112.242 0.46 . . . . 25.0 112.242 -171.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.6 p -143.42 154.96 44.24 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 176.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.135 -0.936 . . . . 25.0 111.086 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.0 m170 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.891 0.377 . . . . 25.0 110.658 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.55 165.89 20.37 Favored Glycine 0 C--O 1.229 -0.167 1 N-CA-C 102.362 -4.295 . . . . 25.0 102.362 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -148.04 163.55 36.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 120.561 2.181 . . . . 25.0 111.916 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -100.2 123.36 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -77.8 -42.61 33.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.604 -1.18 . . . . 25.0 110.265 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -152.45 129.23 5.5 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.91 131.55 11.4 Favored 'Cis proline' 0 C--N 1.348 0.502 0 CA-C-N 118.83 0.618 . . . . 25.0 111.118 -0.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 109.87 2.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.931 -0.577 . . . . 25.0 112.15 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 t -72.03 157.55 37.59 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -56.09 -24.3 39.41 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.337 0.655 . . . . 25.0 111.985 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.12 -53.69 41.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.803 0.811 . . . . 25.0 109.262 175.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -67.11 -36.42 81.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 25.0 110.463 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -61.92 -32.55 72.96 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 121.106 -0.237 . . . . 25.0 111.028 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -40.84 97.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.306 0.574 . . . . 25.0 110.519 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.472 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.77 -33.04 70.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.066 0.46 . . . . 25.0 110.031 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.1 mt -76.12 5.4 6.83 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.425 -0.352 . . . . 25.0 111.777 175.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 62.9 14.82 7.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.621 1.168 . . . . 25.0 113.352 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.473 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.1 mt -84.06 -22.55 31.18 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.719 -0.845 . . . . 25.0 108.719 176.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.473 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.7 m120 -124.46 158.91 31.7 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 104.792 -2.299 . . . . 25.0 104.792 176.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.9 p -137.65 174.01 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.081 -0.341 . . . . 25.0 110.081 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 70.25 5.02 5.13 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 116.681 2.104 . . . . 25.0 116.681 176.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.7 m -64.57 -32.33 73.94 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 121.916 -0.49 . . . . 25.0 110.388 172.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 -63.08 1.79 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.818 0.699 . . . . 25.0 112.023 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.6 t -88.06 -53.48 4.7 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.611 1.196 . . . . 25.0 111.587 -178.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.6 t -68.1 -12.72 16.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.376 -1.284 . . . . 25.0 112.931 -171.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -84.69 -0.82 54.89 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 121.852 -0.53 . . . . 25.0 111.865 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -117.56 -34.16 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.047 -0.661 . . . . 25.0 110.376 172.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.04 104.67 22.63 Favored Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 109.531 -0.544 . . . . 25.0 109.531 171.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.472 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.6 Cg_endo -74.89 -19.78 17.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 116.758 -1.695 . . . . 25.0 113.963 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -86.37 12.85 9.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.934 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -66.48 -14.0 61.62 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.754 0.312 . . . . 25.0 111.613 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 19.4 m -64.02 129.23 27.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 113.839 1.051 . . . . 25.0 113.839 -177.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -152.93 152.4 31.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.383 -1.34 . . . . 25.0 107.383 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.86 -172.96 27.74 Favored Glycine 0 N--CA 1.455 -0.094 0 N-CA-C 108.843 -1.703 . . . . 25.0 108.843 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.0 148.27 47.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 118.426 1.113 . . . . 25.0 111.827 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.14 156.92 32.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.12 -1.437 . . . . 25.0 107.12 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.42 2.13 2.99 Favored Glycine 0 C--N 1.318 -0.45 0 CA-C-N 114.929 -1.032 . . . . 25.0 112.919 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -75.91 141.39 71.52 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -93.0 -13.46 20.96 Favored 'Cis proline' 0 CA--C 1.543 0.948 0 C-N-CA 130.474 1.447 . . . . 25.0 115.469 -6.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.88 -37.07 75.93 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.483 1.29 . . . . 25.0 114.483 -169.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.01 30.91 6.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.251 -2.129 . . . . 25.0 105.251 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.98 179.05 43.92 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.899 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -62.6 173.0 3.91 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.743 2.295 . . . . 25.0 113.628 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.01 30.99 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -60.54 140.02 57.52 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 107.001 -1.481 . . . . 25.0 107.001 174.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.03 -5.01 78.42 Favored Glycine 0 N--CA 1.459 0.176 0 CA-C-O 121.817 0.676 . . . . 25.0 112.583 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -126.03 8.4 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.998 -0.741 . . . . 25.0 108.998 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.94 -52.76 49.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 122.308 -0.245 . . . . 25.0 111.637 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.57 -21.11 59.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.372 -0.603 . . . . 25.0 109.372 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.0 p -81.86 -7.62 59.62 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.597 0.592 . . . . 25.0 112.597 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.29 31.19 11.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.512 0.725 . . . . 25.0 110.33 -173.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.57 36.58 25.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.715 1.376 . . . . 25.0 114.715 -176.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -120.73 136.29 54.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.992 0.517 . . . . 25.0 110.585 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.08 -33.89 75.27 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 115.234 1.568 . . . . 25.0 115.234 -174.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 55' ' ' THR . 1.5 t -71.12 -7.15 44.62 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.622 0.601 . . . . 25.0 112.622 -178.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.67 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.7 m-85 -120.84 13.09 11.43 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -71.37 -37.23 71.64 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.243 -0.91 . . . . 25.0 111.338 -176.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -69.82 -17.98 63.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.294 1.045 . . . . 25.0 108.757 177.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.67 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -85.51 -8.19 58.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.081 -0.963 . . . . 25.0 109.174 -177.384 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -113.12 -36.13 5.16 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.671 1.36 . . . . 25.0 114.671 176.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -104.92 125.94 51.46 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.102 -0.999 . . . . 25.0 110.821 -176.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.5 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.4 pm0 -127.73 161.05 29.84 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.286 -1.325 . . . . 25.0 110.029 -176.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -112.6 162.66 20.54 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 100.663 -3.829 . . . . 25.0 100.663 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -70.45 -0.14 7.04 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 N-CA-C 116.129 1.55 . . . . 25.0 116.129 -174.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -127.92 13.64 6.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.587 0.708 . . . . 25.0 110.251 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -30.48 45.19 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.825 1.046 . . . . 25.0 113.825 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.5 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 15.8 m95 -126.77 167.89 15.16 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.599 -0.519 . . . . 25.0 109.599 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -66.46 126.89 30.27 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.246 -1.761 . . . . 25.0 106.246 171.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -98.97 106.19 18.42 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 100.543 -3.873 . . . . 25.0 100.543 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.63 134.66 52.77 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.06 -0.973 . . . . 25.0 110.259 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -91.69 100.66 13.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.691 -1.14 . . . . 25.0 108.021 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.5 mt -131.89 173.96 10.65 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.135 -1.061 . . . . 25.0 108.135 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.78 156.38 23.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.944 -176.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 139' ' ' ALA . 53.3 p -77.13 167.9 20.99 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.163 -1.421 . . . . 25.0 107.163 172.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.26 -160.78 23.04 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 110.518 -1.033 . . . . 25.0 110.518 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.87 132.98 50.81 Favored 'Trans proline' 0 C--N 1.345 0.387 0 CA-C-N 119.202 1.501 . . . . 25.0 114.079 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.31 161.98 36.39 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.7 p -101.52 150.86 22.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.829 -1.175 . . . . 25.0 107.829 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -137.66 100.96 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.98 121.46 45.41 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 123.923 0.889 . . . . 25.0 109.52 -177.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -107.36 152.18 24.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.035 -0.984 . . . . 25.0 110.161 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -129.35 114.54 16.33 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 104.789 -2.3 . . . . 25.0 104.789 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.8 mp -115.05 117.87 31.8 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.193 -173.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -81.91 6.58 15.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.302 0.572 . . . . 25.0 111.272 173.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -122.62 132.32 54.23 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.979 -0.451 . . . . 25.0 110.345 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -80.63 -9.63 59.78 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.874 0.694 . . . . 25.0 112.874 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.15 155.58 31.16 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.19 0.441 . . . . 25.0 112.19 -176.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 t -76.99 155.89 32.3 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.819 0.818 . . . . 25.0 112.859 -175.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.463 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 6.6 t -97.92 158.24 15.64 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.502 -1.296 . . . . 25.0 107.502 173.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -117.92 -15.6 9.98 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.102 0.251 . . . . 25.0 111.195 172.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -171.99 150.25 2.52 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.312 0.486 . . . . 25.0 112.312 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -123.94 138.54 54.45 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.457 -2.423 . . . . 25.0 104.457 167.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.6 mtt-85 -137.27 144.76 42.87 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -137.94 127.52 25.05 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.686 -1.598 . . . . 25.0 106.686 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -147.74 168.76 21.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.675 -0.861 . . . . 25.0 108.675 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.51 167.38 26.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 113.394 0.887 . . . . 25.0 113.394 -168.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.3 p -79.06 160.53 27.07 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.735 . . . . 25.0 106.317 167.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -62.13 159.0 41.66 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.708 -0.678 . . . . 25.0 109.553 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.26 -24.53 37.6 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 116.923 -1.584 . . . . 25.0 113.056 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -115.02 32.06 6.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.092 0.557 . . . . 25.0 110.762 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -72.68 165.42 24.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.135 0.969 . . . . 25.0 113.577 -174.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -83.17 101.04 10.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.377 -1.283 . . . . 25.0 110.293 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.93 7.99 28.34 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 117.715 2.487 . . . . 25.0 117.715 -168.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.0 t -123.44 8.32 9.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.778 0.799 . . . . 25.0 109.231 176.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -107.25 160.52 26.18 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 114.541 -1.209 . . . . 25.0 108.916 -172.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -64.53 152.51 81.42 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 118.051 -0.833 . . . . 25.0 111.412 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -71.59 100.14 2.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.498 0.666 . . . . 25.0 110.868 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -88.96 153.97 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.503 -1.295 . . . . 25.0 107.503 176.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.21 -25.93 68.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.257 0.551 . . . . 25.0 111.167 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.47 61.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.333 -0.849 . . . . 25.0 112.801 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.4 t -79.29 -3.93 48.36 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.196 0.443 . . . . 25.0 112.196 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -106.01 155.58 19.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -96.47 91.24 5.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 101.952 -3.351 . . . . 25.0 101.952 161.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.82 -7.11 37.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -171.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.39 119.6 77.79 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.862 -1.162 . . . . 25.0 107.862 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -72.09 143.27 39.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 114.998 -2.868 . . . . 25.0 112.416 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -95.0 -14.59 24.22 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.064 0.394 . . . . 25.0 112.064 -176.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 75.1 m -147.94 62.77 1.12 Allowed 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.827 0.306 . . . . 25.0 111.827 178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -88.96 139.46 30.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 118.24 -1.384 . . . . 25.0 108.705 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -124.92 99.12 5.99 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -92.47 92.12 7.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.016 -1.476 . . . . 25.0 107.016 -176.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -106.15 117.9 35.24 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.438 -0.949 . . . . 25.0 108.438 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -96.92 77.88 0.69 Allowed Glycine 0 CA--C 1.504 -0.628 0 CA-C-N 115.45 -0.795 . . . . 25.0 114.023 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.93 20.39 5.3 Favored Glycine 0 C--N 1.321 -0.275 0 C-N-CA 120.882 -0.675 . . . . 25.0 113.862 178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.38 105.13 5.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.497 0.665 . . . . 25.0 109.828 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.24 125.99 91.24 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 105.563 -2.014 . . . . 25.0 105.563 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.5 169.14 23.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 118.369 -0.621 . . . . 25.0 113.598 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.22 31.49 4.26 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.372 -1.344 . . . . 25.0 107.372 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.66 -17.94 0.27 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.94 1.696 . . . . 25.0 112.132 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.9 mt-30 -129.25 155.47 45.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 104.703 -2.332 . . . . 25.0 104.703 171.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.1 t -140.72 95.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.417 -2.068 . . . . 25.0 105.417 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.9 t -95.52 142.58 27.7 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -156.95 167.03 31.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 113.709 -1.587 . . . . 25.0 108.628 -175.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -129.77 156.89 43.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.88 -1.526 . . . . 25.0 106.88 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.12 161.35 31.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.483 -1.302 . . . . 25.0 107.483 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -105.09 117.16 33.3 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.085 0.241 . . . . 25.0 111.101 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.54 132.25 69.48 Favored Pre-proline 0 CA--C 1.541 0.628 0 N-CA-C 107.888 -1.152 . . . . 25.0 107.888 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -61.26 145.75 98.14 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-O 121.705 0.627 . . . . 25.0 113.472 -179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.429 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.62 -25.64 35.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.178 -0.919 . . . . 25.0 112.665 -168.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -84.24 9.77 12.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.611 0.719 . . . . 25.0 110.212 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -115.18 53.55 0.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.345 -0.983 . . . . 25.0 108.345 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.9 p -86.12 165.45 16.59 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 106.748 -1.575 . . . . 25.0 106.748 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.14 -167.08 32.68 Favored Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 115.368 0.907 . . . . 25.0 115.368 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.7 t -86.0 108.13 18.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.959 0.409 . . . . 25.0 110.799 -168.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 38.5 p-80 -158.53 168.39 27.04 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 113.816 1.043 . . . . 25.0 113.816 -174.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 16.1 t -100.91 146.24 9.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.376 -0.972 . . . . 25.0 108.376 -179.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.81 129.65 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 102.114 -3.291 . . . . 25.0 102.114 179.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.44 132.57 54.98 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.522 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -113.09 111.88 22.88 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -106.31 142.19 19.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.356 0.598 . . . . 25.0 110.087 -176.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.463 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 18.2 t90 -123.63 124.31 42.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.0 -1.0 . . . . 25.0 108.608 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -105.21 129.46 53.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.998 -0.742 . . . . 25.0 108.998 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.2 mm -85.97 141.11 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.313 -0.625 . . . . 25.0 109.313 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.78 20.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.714 0.688 . . . . 25.0 110.528 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -23.33 64.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.077 1.14 . . . . 25.0 114.077 -171.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.5 p -138.39 169.9 16.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 122.046 0.926 . . . . 25.0 110.32 -174.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.97 19.05 0.73 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.999 -1.0 . . . . 25.0 112.325 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -90.3 147.62 23.38 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.66 -0.65 . . . . 25.0 112.528 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.05 144.67 19.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 104.414 -2.439 . . . . 25.0 104.414 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -143.43 147.94 35.37 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.721 0.237 . . . . 25.0 110.51 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -109.4 107.76 18.04 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.856 0.863 . . . . 25.0 109.666 -174.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.13 20.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.189 0.519 . . . . 25.0 110.142 -177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.56 145.93 26.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.953 -0.567 . . . . 25.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.87 147.09 32.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 103.782 -2.673 . . . . 25.0 103.782 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -110.75 130.64 55.52 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.241 -1.762 . . . . 25.0 106.241 176.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.0 m -132.76 162.45 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.738 0.644 . . . . 25.0 112.738 -173.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -117.98 95.12 4.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 104.336 -2.468 . . . . 25.0 104.336 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.89 163.99 13.83 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 112.919 0.711 . . . . 25.0 112.919 -171.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.4 p -144.74 164.43 31.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.977 -1.12 . . . . 25.0 107.977 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.839 0 CA-C-O 117.592 -1.194 . . . . 25.0 111.959 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.1 m170 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.332 -0.248 . . . . 25.0 110.332 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.33 165.14 33.04 Favored Glycine 0 CA--C 1.509 -0.284 1 N-CA-C 102.887 -4.085 . . . . 25.0 102.887 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -145.78 158.4 43.86 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 119.668 1.734 . . . . 25.0 110.984 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.15 119.56 34.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.72 -43.15 48.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.279 -1.328 . . . . 25.0 109.319 -174.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.8 t -155.37 128.38 4.26 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -63.9 128.52 7.13 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 C-N-CA 129.706 1.128 . . . . 25.0 112.346 0.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.75 116.83 8.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.777 0.658 . . . . 25.0 112.777 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.4 t -72.11 157.84 37.02 Favored 'General case' 0 C--O 1.216 -0.665 0 N-CA-C 109.011 -0.737 . . . . 25.0 109.011 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.93 -25.12 41.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.602 0.761 . . . . 25.0 111.656 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -52.76 44.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.755 0.788 . . . . 25.0 109.155 175.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.94 -36.72 84.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 25.0 110.308 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -63.65 -33.74 76.29 Favored 'General case' 0 C--O 1.219 -0.531 0 O-C-N 122.223 -0.298 . . . . 25.0 110.899 178.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -40.26 96.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.342 0.591 . . . . 25.0 109.915 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.423 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 6.3 tmtm? -68.45 -33.85 74.92 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.212 0.529 . . . . 25.0 110.311 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.5 mt -79.08 5.14 12.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 25.0 111.276 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 58.7 24.77 12.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.177 1.391 . . . . 25.0 112.909 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.457 ' C ' HD22 ' A' ' 19' ' ' ASN . 89.3 mt -89.7 -21.44 22.72 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.914 -1.143 . . . . 25.0 107.914 174.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.457 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.51 160.28 27.3 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 105.669 -1.974 . . . . 25.0 105.669 177.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 42.6 p -134.31 175.13 9.78 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 122.449 0.3 . . . . 25.0 110.456 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 69.39 5.23 5.03 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.877 1.806 . . . . 25.0 115.877 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -66.67 -38.52 86.99 Favored 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 121.344 -0.848 . . . . 25.0 111.145 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -63.33 1.54 Allowed Glycine 0 C--O 1.218 -0.9 0 O-C-N 123.55 0.531 . . . . 25.0 112.449 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -53.73 4.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.549 1.166 . . . . 25.0 111.806 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -7.03 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.603 -1.18 . . . . 25.0 113.63 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.419 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.6 pt20 -88.27 2.0 53.32 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.8 -0.563 . . . . 25.0 111.102 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -117.65 -34.05 4.36 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.742 -0.383 . . . . 25.0 110.791 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -126.93 107.62 22.2 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 172.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.423 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 84.1 Cg_endo -76.9 -18.55 14.71 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 116.867 -1.622 . . . . 25.0 113.797 -171.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -90.66 12.01 20.34 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.64 0.607 . . . . 25.0 112.64 -177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.0 m -62.18 -17.93 59.5 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.092 0.472 . . . . 25.0 112.121 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.418 ' H ' HG22 ' A' ' 32' ' ' VAL . 2.2 m -64.1 120.65 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.81 0.814 . . . . 25.0 112.695 -179.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -152.99 156.5 38.96 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.56 -169.05 24.34 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -176.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.7 tp -118.18 147.77 43.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.216 1.008 . . . . 25.0 111.917 -176.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.46 156.88 31.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 172.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 139.95 1.69 1.76 Allowed Glycine 0 C--O 1.223 -0.536 0 CA-C-N 114.768 -1.105 . . . . 25.0 113.195 179.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -75.99 139.07 69.07 Favored Pre-proline 0 C--N 1.321 -0.655 0 O-C-N 121.569 -0.959 . . . . 25.0 109.631 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.2 -13.13 21.23 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 C-N-CA 130.438 1.433 . . . . 25.0 115.509 -6.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -71.63 -36.76 70.86 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -168.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.69 31.95 5.74 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.26 -174.42 42.05 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.336 -1.302 . . . . 25.0 110.859 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -61.96 170.26 6.33 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.446 2.097 . . . . 25.0 113.097 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 159.97 31.12 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 106.592 -1.633 . . . . 25.0 106.592 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.62 138.84 58.01 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.563 -1.199 . . . . 25.0 108.34 177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.36 -4.12 82.46 Favored Glycine 0 C--O 1.227 -0.296 0 C-N-CA 121.216 -0.516 . . . . 25.0 112.844 -174.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -124.45 9.08 8.42 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.656 -0.868 . . . . 25.0 108.656 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.79 -47.27 86.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 O-C-N 122.405 -0.185 . . . . 25.0 110.906 -172.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.02 -18.46 58.13 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.024 -0.423 . . . . 25.0 110.182 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 p -87.97 -7.17 57.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.41 32.81 11.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.659 0.784 . . . . 25.0 110.412 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.96 37.08 24.69 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -177.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -120.7 137.28 54.55 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.124 0.569 . . . . 25.0 111.11 175.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.7 p -62.62 -35.43 79.54 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.378 1.621 . . . . 25.0 115.378 -174.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -71.56 -6.97 44.68 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.615 0.598 . . . . 25.0 112.615 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.684 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.6 m-85 -120.44 11.91 11.51 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 107.32 -1.363 . . . . 25.0 107.32 -179.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.62 -34.47 67.35 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.051 -1.031 . . . . 25.0 110.084 -175.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -71.27 -15.56 62.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.947 0.879 . . . . 25.0 109.945 174.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.684 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.91 -6.48 58.04 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 -177.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.55 -32.36 6.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.097 0.475 . . . . 25.0 111.81 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -98.15 121.91 40.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 121.743 -0.598 . . . . 25.0 110.052 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -129.68 160.97 31.69 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.022 -0.733 . . . . 25.0 109.022 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.7 p -115.79 162.39 25.64 Favored Pre-proline 0 C--N 1.321 -0.666 1 N-CA-C 100.108 -4.034 . . . . 25.0 100.108 162.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.9 -4.9 14.34 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 116.744 -1.704 . . . . 25.0 115.586 -175.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -125.15 10.7 8.13 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.079 0.466 . . . . 25.0 111.783 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -77.72 -30.14 51.59 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.657 -0.652 . . . . 25.0 112.593 -176.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 10.4 m95 -125.07 164.7 19.63 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.85 -0.426 . . . . 25.0 109.85 -178.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -66.83 129.15 38.95 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 171.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -100.9 105.54 16.81 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 100.694 -3.817 . . . . 25.0 100.694 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.9 mp -68.54 136.31 52.92 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.12 -0.946 . . . . 25.0 110.784 -176.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -88.26 111.92 22.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.915 -1.039 . . . . 25.0 108.856 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.1 mt -137.09 173.19 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.143 -1.058 . . . . 25.0 108.143 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.22 156.3 25.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.704 -0.68 . . . . 25.0 110.467 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.442 HG21 ' HA ' ' A' ' 139' ' ' ALA . 70.5 p -76.95 170.47 16.45 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 173.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 92.44 -161.87 26.54 Favored Glycine 0 C--O 1.239 0.456 0 CA-C-O 118.95 -0.917 . . . . 25.0 110.95 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -58.94 131.2 40.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 CA-C-N 119.149 1.475 . . . . 25.0 113.517 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -139.26 163.11 33.33 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.093 -1.447 . . . . 25.0 107.093 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.8 p -104.17 152.45 22.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.03 -1.1 . . . . 25.0 108.03 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -140.62 101.09 4.01 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 104.917 -2.253 . . . . 25.0 104.917 -177.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.98 134.98 49.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -120.35 153.21 36.79 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.962 -1.472 . . . . 25.0 109.542 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -130.44 117.25 19.39 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 104.21 -2.515 . . . . 25.0 104.21 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.9 137.64 52.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.139 -0.937 . . . . 25.0 111.22 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.8 t -92.75 2.36 56.78 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.984 0.421 . . . . 25.0 111.219 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -128.57 139.46 52.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.932 0.396 . . . . 25.0 111.142 -177.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.3 mmm-85 -92.06 1.77 56.99 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.895 -0.593 . . . . 25.0 112.49 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.25 148.81 49.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.591 -0.444 . . . . 25.0 110.083 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.4 t -71.8 155.93 39.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.078 1.14 . . . . 25.0 114.078 -170.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.448 HG21 ' HE1' ' A' ' 92' ' ' TRP . 14.8 t -99.03 159.45 14.95 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.179 -1.045 . . . . 25.0 108.179 173.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -117.96 -13.75 10.03 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.125 0.266 . . . . 25.0 110.589 170.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.62 151.87 2.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.803 0.335 . . . . 25.0 111.325 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.448 ' HE1' HG21 ' A' ' 89' ' ' THR . 63.1 m95 -122.72 141.51 51.71 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.274 -2.491 . . . . 25.0 104.274 165.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -145.34 152.98 40.74 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.727 -1.212 . . . . 25.0 107.727 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -136.71 134.81 37.58 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.786 -1.931 . . . . 25.0 105.786 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.59 165.23 31.0 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.196 0.453 . . . . 25.0 109.822 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.01 167.83 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 113.713 1.005 . . . . 25.0 113.713 -166.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.9 p -82.25 163.78 21.62 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.235 -1.024 . . . . 25.0 108.235 168.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.39 159.38 41.26 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.349 -0.842 . . . . 25.0 109.355 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.87 -24.23 34.2 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 116.063 -2.158 . . . . 25.0 113.581 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -115.58 31.87 6.43 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 122.915 0.486 . . . . 25.0 111.069 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' TRP . . . . . 0.495 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 7.0 p-90 -71.98 166.57 21.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.13 0.967 . . . . 25.0 112.524 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.06 101.04 10.87 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.51 -1.223 . . . . 25.0 109.212 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.495 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.11 15.13 10.76 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 116.041 1.867 . . . . 25.0 116.041 -169.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -128.1 13.2 6.71 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.701 -0.852 . . . . 25.0 108.701 176.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -117.54 157.24 48.11 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.521 -1.218 . . . . 25.0 107.976 -174.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -64.93 153.2 79.33 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 O-C-N 121.961 0.453 . . . . 25.0 111.798 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.63 103.77 4.34 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.58 0.705 . . . . 25.0 112.308 -175.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 19.9 p -98.02 161.41 13.74 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.157 -0.683 . . . . 25.0 109.157 177.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -68.03 -23.39 64.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.234 0.54 . . . . 25.0 111.029 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.69 63.4 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.212 -0.904 . . . . 25.0 112.034 176.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.3 m -85.65 -9.73 56.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.115 0.483 . . . . 25.0 111.415 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -95.54 154.58 17.13 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 114.363 1.245 . . . . 25.0 114.363 -177.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -97.74 94.27 6.85 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 102.512 -3.144 . . . . 25.0 102.512 161.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.47 -7.51 20.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.569 1.322 . . . . 25.0 114.569 -170.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -81.79 132.47 54.43 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.061 -0.718 . . . . 25.0 109.061 177.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -72.66 150.92 51.54 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 115.01 -2.86 . . . . 25.0 110.615 176.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -102.32 -9.84 20.01 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.961 0.41 . . . . 25.0 111.17 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 47.7 m -151.86 70.82 0.95 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 25.0 109.793 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.08 135.14 33.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.06 -1.056 . . . . 25.0 108.964 176.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -121.22 99.1 6.3 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.168 -2.901 . . . . 25.0 103.168 177.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -90.32 91.93 8.7 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -113.68 118.44 34.36 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 107.763 -1.199 . . . . 25.0 107.763 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.32 83.71 0.38 Allowed Glycine 0 CA--C 1.5 -0.874 0 CA-C-N 115.311 -0.859 . . . . 25.0 112.564 -170.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.33 14.04 6.64 Favored Glycine 0 C--N 1.32 -0.313 0 C-N-CA 121.054 -0.593 . . . . 25.0 113.253 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.31 105.56 5.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.58 0.705 . . . . 25.0 109.334 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -74.39 121.62 85.64 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 107.039 -1.467 . . . . 25.0 107.039 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -72.32 162.89 40.28 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 118.267 -0.689 . . . . 25.0 112.933 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -100.14 27.58 5.51 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.665 -0.865 . . . . 25.0 108.665 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.03 -9.79 0.82 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.604 1.561 . . . . 25.0 111.676 -174.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -132.26 151.81 51.65 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 103.49 -2.782 . . . . 25.0 103.49 170.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 49.4 t -142.03 95.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.638 . . . . 25.0 106.576 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -90.99 138.36 31.67 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.49 164.93 30.97 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 106.287 -1.746 . . . . 25.0 106.287 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -136.46 149.01 48.01 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.962 -2.236 . . . . 25.0 104.962 174.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 160.94 31.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.328 -1.36 . . . . 25.0 107.328 -176.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -101.16 118.44 36.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.528 0.204 . . . . 25.0 111.368 -177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.3 mt -78.94 132.64 63.35 Favored Pre-proline 0 CA--C 1.541 0.625 0 N-CA-C 107.831 -1.174 . . . . 25.0 107.831 176.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -61.52 146.84 96.64 Favored 'Trans proline' 0 C--N 1.355 0.872 0 CA-C-O 121.611 0.588 . . . . 25.0 113.492 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.442 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.84 -26.83 33.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.162 -0.927 . . . . 25.0 112.56 -169.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -84.35 9.48 13.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.582 -0.736 . . . . 25.0 110.376 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -113.32 52.98 0.78 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.677 -0.86 . . . . 25.0 108.677 171.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.1 p -85.99 161.72 18.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.48 -165.41 31.14 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 115.562 0.985 . . . . 25.0 115.562 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.1 t -85.82 109.05 18.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.443 0.64 . . . . 25.0 111.267 -168.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.5 p-80 -158.31 171.51 20.04 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.777 -0.647 . . . . 25.0 110.379 -176.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.37 150.64 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.5 mt -132.99 129.29 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 N-CA-C 101.478 -3.527 . . . . 25.0 101.478 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 137.53 53.58 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.102 -0.499 . . . . 25.0 109.78 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -119.02 134.68 55.04 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 109.561 -0.533 . . . . 25.0 109.561 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -124.52 140.09 48.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.126 0.965 . . . . 25.0 111.762 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -111.44 109.7 19.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 113.495 -1.684 . . . . 25.0 106.675 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -91.08 121.5 32.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.431 -1.322 . . . . 25.0 107.431 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.2 mm -79.65 141.75 14.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.528 -0.545 . . . . 25.0 109.528 -178.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.33 -42.14 23.51 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.699 0.681 . . . . 25.0 110.163 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.0 -24.72 65.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.592 0.96 . . . . 25.0 113.592 -172.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 63.5 p -139.53 169.52 17.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.938 0.875 . . . . 25.0 110.084 -174.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.04 23.67 0.55 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.193 -0.912 . . . . 25.0 112.295 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -92.77 146.28 23.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.991 0.738 . . . . 25.0 112.991 -176.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.25 143.12 10.35 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.785 -1.932 . . . . 25.0 105.785 172.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -148.77 132.87 17.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 111.676 0.25 . . . . 25.0 111.676 178.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.12 114.9 26.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.414 0.446 . . . . 25.0 110.821 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -97.11 108.14 20.81 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.65 -0.87 . . . . 25.0 108.65 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.26 139.9 35.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.236 -0.893 . . . . 25.0 113.201 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -125.98 132.69 70.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.998 -1.853 . . . . 25.0 105.998 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -91.39 130.28 37.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.377 -1.342 . . . . 25.0 107.377 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.83 162.19 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.941 0.719 . . . . 25.0 112.941 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -119.95 95.64 4.85 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 104.47 -2.418 . . . . 25.0 104.47 168.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.41 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.03 163.23 14.99 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.483 0.549 . . . . 25.0 112.483 -172.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.2 p -143.36 156.31 44.65 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.944 -1.132 . . . . 25.0 107.944 176.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.013 -0.994 . . . . 25.0 111.466 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.8 m80 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.951 0.405 . . . . 25.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.89 177.27 33.86 Favored Glycine 0 CA--C 1.508 -0.352 1 N-CA-C 101.928 -4.469 . . . . 25.0 101.928 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -145.84 163.95 33.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 119.973 1.886 . . . . 25.0 109.689 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -100.74 122.01 52.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 106.497 -1.668 . . . . 25.0 106.497 175.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.23 -42.37 59.84 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.634 -1.166 . . . . 25.0 109.684 -174.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.7 t -153.53 130.18 5.63 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 105.653 -1.98 . . . . 25.0 105.653 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -65.2 132.13 14.46 Favored 'Cis proline' 0 C--N 1.346 0.433 0 CA-C-N 118.783 0.601 . . . . 25.0 111.09 -0.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.37 111.14 3.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.074 -0.512 . . . . 25.0 111.887 -172.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 t -72.21 157.52 37.58 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 109.06 -0.718 . . . . 25.0 109.06 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.44 -24.66 31.82 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.625 0.77 . . . . 25.0 111.757 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.07 -54.61 23.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.933 0.873 . . . . 25.0 109.52 176.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.23 -37.18 84.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.175 -0.921 . . . . 25.0 110.204 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -62.52 -33.29 74.59 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 122.313 -0.242 . . . . 25.0 110.963 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -39.39 93.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.011 0.434 . . . . 25.0 110.725 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.04 -35.49 74.33 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.183 0.516 . . . . 25.0 109.669 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.1 mt -74.58 2.61 9.35 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.162 -0.472 . . . . 25.0 111.561 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 58.19 23.39 10.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.413 1.485 . . . . 25.0 112.926 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 19' ' ' ASN . 90.0 mt -84.96 -21.82 29.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 173.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.446 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -124.02 158.75 31.4 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.243 -2.132 . . . . 25.0 105.243 176.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.4 p -136.94 176.59 8.57 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.431 -0.581 . . . . 25.0 109.431 -177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 70.51 4.93 5.16 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.579 1.696 . . . . 25.0 115.579 174.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -67.83 -32.54 73.15 Favored 'General case' 0 CA--C 1.496 -1.113 0 O-C-N 121.354 -0.841 . . . . 25.0 110.563 172.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.19 -63.58 1.34 Allowed Glycine 0 C--O 1.215 -1.063 0 O-C-N 123.923 0.765 . . . . 25.0 112.151 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.6 t -88.08 -52.59 5.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.366 1.079 . . . . 25.0 112.343 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 t -65.97 -15.29 18.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 114.57 -1.196 . . . . 25.0 112.849 -172.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HG2' ' H ' ' A' ' 26' ' ' GLN . 14.6 pt20 -84.33 -3.03 58.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.916 -0.49 . . . . 25.0 111.464 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -117.21 -35.65 3.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.182 -0.607 . . . . 25.0 110.264 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -127.0 94.06 40.33 Favored Pre-proline 0 C--O 1.243 0.76 0 N-CA-C 111.83 0.308 . . . . 25.0 111.83 171.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.2 Cg_endo -74.02 -20.64 19.13 Favored 'Trans proline' 0 C--N 1.346 0.396 0 N-CA-C 115.121 1.162 . . . . 25.0 115.121 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -83.74 9.34 12.04 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.851 -0.531 . . . . 25.0 112.123 -177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.8 m -66.65 -16.05 63.92 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.789 0.663 . . . . 25.0 112.789 176.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.6 m -63.97 125.35 20.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.759 1.022 . . . . 25.0 113.759 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -152.95 153.64 33.39 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 105.891 -1.892 . . . . 25.0 105.891 178.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.4 -167.66 16.69 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 108.891 -1.684 . . . . 25.0 108.891 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.0 tp -123.92 142.04 51.5 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 118.261 1.03 . . . . 25.0 111.506 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.07 157.0 29.68 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.822 -1.177 . . . . 25.0 107.822 172.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 132.19 6.98 2.97 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-N 114.804 -1.089 . . . . 25.0 113.507 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -75.77 139.65 70.37 Favored Pre-proline 0 C--N 1.32 -0.678 0 O-C-N 121.564 -0.963 . . . . 25.0 108.889 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -91.87 -15.56 18.95 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 N-CA-C 115.826 1.433 . . . . 25.0 115.826 -5.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -69.18 -36.71 77.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.15 1.537 . . . . 25.0 115.15 -169.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.14 30.28 7.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.641 -1.985 . . . . 25.0 105.641 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.36 -178.0 42.95 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.397 -1.274 . . . . 25.0 110.824 -177.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -62.1 171.75 4.76 Favored 'Trans proline' 0 C--O 1.242 0.686 0 C-N-CA 122.957 2.438 . . . . 25.0 113.391 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.92 160.02 31.12 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.8 -1.556 . . . . 25.0 106.8 173.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.73 138.7 58.07 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 107.694 -1.224 . . . . 25.0 107.694 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.68 -4.71 81.36 Favored Glycine 0 CA--C 1.51 -0.258 0 C-N-CA 121.267 -0.492 . . . . 25.0 113.045 -174.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -124.01 10.02 8.78 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.74 -0.837 . . . . 25.0 108.74 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.68 -49.77 75.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.716 -0.22 . . . . 25.0 111.516 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.07 -21.47 56.71 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.813 -0.554 . . . . 25.0 109.732 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.6 p -82.75 -8.01 59.62 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.565 0.58 . . . . 25.0 112.565 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.19 33.49 12.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.594 0.757 . . . . 25.0 110.547 -172.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.16 39.12 26.3 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.838 1.422 . . . . 25.0 114.838 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -121.38 135.46 55.07 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.025 -0.534 . . . . 25.0 110.654 175.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -62.24 -34.4 76.45 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 115.05 1.5 . . . . 25.0 115.05 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -70.66 -11.48 60.97 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.341 0.591 . . . . 25.0 112.275 -178.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -115.42 13.12 16.45 Favored 'General case' 0 C--O 1.214 -0.776 0 N-CA-C 107.474 -1.306 . . . . 25.0 107.474 -178.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -70.74 -37.11 73.43 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.015 -1.053 . . . . 25.0 110.7 -175.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.9 mp0 -69.42 -15.3 63.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.746 0.784 . . . . 25.0 110.421 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.94 -7.67 57.96 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.349 -0.982 . . . . 25.0 108.349 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -113.2 -33.54 5.95 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.423 0.527 . . . . 25.0 112.423 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -94.31 121.68 36.08 Favored 'General case' 0 CA--C 1.505 -0.774 0 O-C-N 121.602 -0.686 . . . . 25.0 109.697 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.423 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -129.41 161.0 31.37 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.57 -0.741 . . . . 25.0 109.024 177.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.6 p -118.42 161.46 35.23 Favored Pre-proline 0 C--N 1.319 -0.748 1 N-CA-C 99.978 -4.082 . . . . 25.0 99.978 162.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -69.95 0.04 6.36 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 116.993 -1.538 . . . . 25.0 115.923 -174.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.2 t -127.29 9.25 6.66 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.336 0.495 . . . . 25.0 112.336 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -82.26 -31.15 30.29 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.094 1.146 . . . . 25.0 114.094 -175.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.423 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 15.0 m95 -119.61 164.95 15.09 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 110.41 -0.218 . . . . 25.0 110.41 -177.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -67.54 120.09 13.4 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.908 -1.886 . . . . 25.0 105.908 171.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -94.7 103.09 15.0 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 100.849 -3.76 . . . . 25.0 100.849 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.18 135.09 55.04 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.935 -1.03 . . . . 25.0 110.397 -177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -89.59 100.88 13.59 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.515 -1.22 . . . . 25.0 107.921 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.4 mt -130.26 173.85 10.39 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 -176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.64 157.08 23.58 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.584 -0.734 . . . . 25.0 111.008 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.405 HG21 ' HA ' ' A' ' 139' ' ' ALA . 58.6 p -77.12 167.12 22.31 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 106.703 -1.591 . . . . 25.0 106.703 172.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.14 -160.62 24.03 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 110.487 -1.045 . . . . 25.0 110.487 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.06 132.57 48.01 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 119.122 1.461 . . . . 25.0 114.43 -176.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -138.58 161.68 36.47 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.13 -1.804 . . . . 25.0 106.13 177.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.8 p -103.38 149.85 24.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.724 -1.214 . . . . 25.0 107.724 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -137.14 100.97 4.41 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 105.521 -2.029 . . . . 25.0 105.521 -178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.31 114.72 28.8 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.105 0.955 . . . . 25.0 110.065 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -98.88 146.68 25.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.148 -0.933 . . . . 25.0 109.593 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -125.29 110.43 14.0 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 104.605 -2.368 . . . . 25.0 104.605 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -107.36 135.73 48.36 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.74 -0.664 . . . . 25.0 111.007 -172.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.6 t -98.93 16.15 23.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.856 0.836 . . . . 25.0 109.183 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -131.23 135.0 47.0 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.415 -0.587 . . . . 25.0 109.415 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -87.72 -11.98 46.63 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.391 0.515 . . . . 25.0 112.391 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.54 160.72 32.2 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.665 0.617 . . . . 25.0 112.665 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 155.96 39.75 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 116.101 1.889 . . . . 25.0 116.101 -171.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.7 t -102.55 159.24 15.62 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 107.973 -1.121 . . . . 25.0 107.973 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.3 t -117.9 -14.73 10.04 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.069 0.396 . . . . 25.0 112.069 172.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.3 t -171.23 153.61 3.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.022 0.439 . . . . 25.0 112.179 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -127.9 139.14 52.78 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 169.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -146.72 152.73 39.29 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.361 -0.977 . . . . 25.0 108.361 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -137.98 135.76 36.3 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.41 -1.7 . . . . 25.0 106.41 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.28 163.36 37.9 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.376 -0.601 . . . . 25.0 109.376 178.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.93 165.77 31.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 113.694 0.998 . . . . 25.0 113.694 -167.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 18.4 p -79.69 162.52 25.16 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 169.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -62.78 159.14 47.03 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.474 -0.784 . . . . 25.0 108.963 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.13 -25.54 31.42 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 116.194 -2.071 . . . . 25.0 113.985 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -113.93 32.03 6.14 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 122.811 0.444 . . . . 25.0 110.736 -175.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.491 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.2 p-90 -71.7 166.62 21.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.958 0.885 . . . . 25.0 112.818 -176.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.87 101.0 10.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.658 -1.155 . . . . 25.0 109.504 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.491 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -91.59 12.95 19.29 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 116.706 2.113 . . . . 25.0 116.706 -168.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.1 t -125.51 12.44 8.07 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.252 -1.018 . . . . 25.0 108.252 175.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.9 mp0 -114.09 157.12 43.02 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.374 -1.285 . . . . 25.0 107.886 -174.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.36 153.16 79.07 Favored 'Trans proline' 0 CA--C 1.533 0.451 0 O-C-N 121.953 0.449 . . . . 25.0 111.59 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 102.56 2.89 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.383 0.611 . . . . 25.0 111.932 -176.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.1 p -89.13 156.54 18.75 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.154 -1.054 . . . . 25.0 108.154 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.4 ptp180 -65.56 -25.89 67.62 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.265 0.555 . . . . 25.0 110.85 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.44 60.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.816 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.5 t -78.76 -7.68 58.01 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.37 0.507 . . . . 25.0 112.37 -177.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 66.1 m-85 -101.63 158.05 16.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.469 1.285 . . . . 25.0 114.469 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -95.72 95.42 8.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 102.655 -3.091 . . . . 25.0 102.655 162.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.1 mt -66.15 -7.58 18.82 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.832 1.419 . . . . 25.0 114.832 -169.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.66 120.25 76.16 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 176.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.52 142.19 43.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.368 -2.621 . . . . 25.0 111.666 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -92.27 -12.31 32.92 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.249 0.462 . . . . 25.0 112.249 -175.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 69.3 m -148.05 64.71 1.1 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.496 -0.32 . . . . 25.0 111.367 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -88.93 130.97 35.34 Favored 'General case' 0 C--N 1.316 -0.889 0 C-N-CA 118.496 -1.282 . . . . 25.0 109.062 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -119.79 99.08 6.42 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 103.689 -2.708 . . . . 25.0 103.689 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -94.02 91.83 7.05 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.6 118.84 37.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 104.424 -2.436 . . . . 25.0 104.424 173.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.35 81.8 0.41 Allowed Glycine 0 CA--C 1.502 -0.758 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.423 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.79 14.81 4.59 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.973 -0.632 . . . . 25.0 113.168 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.86 106.16 5.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.591 0.71 . . . . 25.0 109.691 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.1 mt -71.6 123.94 90.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 105.353 -2.092 . . . . 25.0 105.353 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.79 168.87 23.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 N-CA-C 113.765 0.641 . . . . 25.0 113.765 -174.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.82 26.77 4.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.51 -17.05 0.29 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 125.823 1.649 . . . . 25.0 112.188 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.9 mt-30 -128.21 153.13 47.26 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.034 -2.58 . . . . 25.0 104.034 169.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.8 t -142.82 95.1 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 106.82 -1.548 . . . . 25.0 106.82 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.2 t -94.01 126.64 39.35 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.74 166.99 21.68 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 105.416 -2.068 . . . . 25.0 105.416 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -130.71 154.39 48.0 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.581 -2.007 . . . . 25.0 105.581 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.63 160.19 36.24 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.628 -1.249 . . . . 25.0 107.628 -178.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -104.38 116.43 32.12 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.192 0.307 . . . . 25.0 111.346 -176.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.4 mt -77.29 132.4 70.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.121 -1.066 . . . . 25.0 108.121 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -61.14 146.43 97.59 Favored 'Trans proline' 0 C--N 1.354 0.846 0 CA-C-O 121.655 0.606 . . . . 25.0 113.547 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.405 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.85 -26.11 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.197 -0.91 . . . . 25.0 112.802 -168.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.9 p-10 -84.16 9.69 12.1 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.545 0.688 . . . . 25.0 110.153 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.2 53.39 0.83 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.76 0.791 . . . . 25.0 108.977 172.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -86.04 169.32 13.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.409 -1.33 . . . . 25.0 107.409 175.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.75 -167.72 37.04 Favored Glycine 0 N--CA 1.451 -0.338 0 N-CA-C 115.733 1.053 . . . . 25.0 115.733 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -85.95 107.81 17.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.534 0.683 . . . . 25.0 110.478 -169.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 45.7 p-80 -157.21 171.92 19.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.678 -0.692 . . . . 25.0 110.512 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.9 p -108.03 150.64 10.54 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.125 -1.065 . . . . 25.0 108.125 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.8 mt -132.04 122.7 49.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 104.247 -2.501 . . . . 25.0 104.247 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.6 mp -105.05 127.68 52.99 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.588 -0.733 . . . . 25.0 110.004 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.16 127.59 55.98 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.851 -0.796 . . . . 25.0 108.851 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.4 p -123.63 140.62 46.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 122.075 0.94 . . . . 25.0 112.016 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 8.6 t90 -117.77 119.4 34.79 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.09 124.18 42.49 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.673 -0.862 . . . . 25.0 108.673 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.9 mm -76.75 141.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.084 -0.71 . . . . 25.0 109.084 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.69 -44.96 22.41 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.192 0.905 . . . . 25.0 110.482 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.14 -21.35 64.93 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -171.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 56.1 p -138.45 169.53 17.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.85 0.833 . . . . 25.0 109.765 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.66 23.2 0.54 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.284 -0.871 . . . . 25.0 112.107 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -94.94 144.12 25.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.846 0.684 . . . . 25.0 112.846 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.36 143.77 16.64 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 104.513 -2.402 . . . . 25.0 104.513 172.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -145.87 134.87 22.62 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.739 0.644 . . . . 25.0 112.739 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.76 113.94 26.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.492 -0.776 . . . . 25.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.02 108.0 20.64 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.198 -1.408 . . . . 25.0 107.198 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.04 141.9 31.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.461 -0.79 . . . . 25.0 111.511 -176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.0 tt -125.37 133.84 68.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 105.478 -2.045 . . . . 25.0 105.478 167.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -93.7 131.26 39.2 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.1 m -132.59 161.07 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -175.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -117.64 95.02 4.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 103.67 -2.715 . . . . 25.0 103.67 167.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.57 163.82 14.44 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.027 -0.533 . . . . 25.0 112.29 -171.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.7 p -145.68 163.37 35.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.015 -1.106 . . . . 25.0 108.015 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 CA-C-O 118.085 -0.96 . . . . 25.0 110.821 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 m80 . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 110.294 -0.262 . . . . 25.0 110.294 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 142.78 169.74 12.47 Favored Glycine 0 C--O 1.229 -0.199 0 N-CA-C 103.283 -3.927 . . . . 25.0 103.283 -173.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -146.14 167.87 22.38 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.886 1.843 . . . . 25.0 109.793 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.92 125.11 64.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 107.103 -1.443 . . . . 25.0 107.103 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.93 -42.6 48.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.945 -1.025 . . . . 25.0 109.951 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.3 t -153.59 129.49 5.28 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 105.755 -1.943 . . . . 25.0 105.755 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -64.24 131.95 12.68 Favored 'Cis proline' 0 CA--C 1.533 0.432 0 C-N-CA 128.774 0.739 . . . . 25.0 111.373 -0.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.54 109.96 3.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.016 -0.538 . . . . 25.0 111.477 -173.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.8 p -72.0 162.42 29.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.559 -0.534 . . . . 25.0 109.559 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -60.0 -22.28 62.38 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.089 0.471 . . . . 25.0 111.765 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.53 19.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.809 -0.812 . . . . 25.0 108.809 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -64.93 -37.76 88.71 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.659 -0.7 . . . . 25.0 110.411 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -63.06 -32.14 73.44 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.311 -0.243 . . . . 25.0 111.058 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -39.62 92.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.051 0.453 . . . . 25.0 110.325 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.451 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.3 tmtm? -69.84 -34.22 73.35 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.168 0.509 . . . . 25.0 109.975 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -75.16 2.88 9.75 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.374 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.71 10.86 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.405 1.482 . . . . 25.0 112.778 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.469 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.6 mt -86.85 -21.71 26.23 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.335 -1.357 . . . . 25.0 107.335 173.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.469 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 157.35 32.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 105.337 -2.097 . . . . 25.0 105.337 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.2 p -135.6 176.21 8.88 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.987 -0.375 . . . . 25.0 109.987 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 72.15 5.29 5.27 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.096 1.517 . . . . 25.0 115.096 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -69.13 -39.7 78.71 Favored 'General case' 0 CA--C 1.502 -0.903 0 O-C-N 121.734 -0.604 . . . . 25.0 110.908 173.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.99 -63.76 2.0 Favored Glycine 0 C--O 1.217 -0.908 0 N-CA-C 111.831 -0.508 . . . . 25.0 111.831 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.3 p -87.98 -52.98 4.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.466 1.127 . . . . 25.0 111.953 -178.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 29' ' ' PRO . 1.0 OUTLIER -68.2 -11.61 14.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 114.324 -1.307 . . . . 25.0 112.708 -171.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.22 -0.76 57.21 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.918 -0.489 . . . . 25.0 111.896 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -117.12 -35.44 4.07 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.679 -0.809 . . . . 25.0 109.845 172.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -127.04 94.8 38.38 Favored Pre-proline 0 CA--C 1.543 0.68 0 N-CA-C 111.797 0.295 . . . . 25.0 111.797 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.451 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 96.5 Cg_endo -71.83 -19.92 26.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 N-CA-C 115.111 1.158 . . . . 25.0 115.111 -177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.54 9.3 13.92 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 121.804 -0.56 . . . . 25.0 112.219 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.8 m -67.61 -14.67 63.14 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.933 0.716 . . . . 25.0 112.933 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.7 m -64.11 131.9 29.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 113.238 0.829 . . . . 25.0 113.238 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -152.94 149.21 27.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.266 -1.012 . . . . 25.0 108.266 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.71 -168.3 17.83 Favored Glycine 0 N--CA 1.452 -0.233 0 N-CA-C 109.503 -1.439 . . . . 25.0 109.503 -178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.92 149.78 49.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.732 0.766 . . . . 25.0 111.213 -177.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.53 156.89 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.217 -1.401 . . . . 25.0 107.217 171.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.52 -0.14 3.4 Favored Glycine 0 C--N 1.318 -0.462 0 CA-C-N 115.099 -0.955 . . . . 25.0 113.373 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -75.93 146.44 79.24 Favored Pre-proline 0 C--N 1.321 -0.653 0 O-C-N 121.678 -0.895 . . . . 25.0 108.669 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.56 -16.97 16.52 Favored 'Cis proline' 0 CA--C 1.542 0.907 0 N-CA-C 115.834 1.436 . . . . 25.0 115.834 -5.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -74.09 -36.91 64.29 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.343 1.238 . . . . 25.0 114.343 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -111.63 32.86 5.11 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 105.322 -2.103 . . . . 25.0 105.322 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.29 -177.38 47.31 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.375 -1.284 . . . . 25.0 110.67 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -62.85 172.75 4.41 Favored 'Trans proline' 0 C--O 1.238 0.502 0 C-N-CA 122.812 2.342 . . . . 25.0 113.784 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.08 30.96 Favored 'General case' 0 N--CA 1.432 -1.336 0 N-CA-C 106.44 -1.689 . . . . 25.0 106.44 173.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 139.47 58.05 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 114.489 -1.232 . . . . 25.0 108.072 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.89 -2.82 87.05 Favored Glycine 0 C--O 1.228 -0.222 0 C-N-CA 121.487 -0.387 . . . . 25.0 112.614 -174.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 47.2 m170 -125.82 9.79 7.63 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.277 -0.543 . . . . 25.0 110.348 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.0 mt -66.29 -45.27 90.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 O-C-N 122.028 -0.42 . . . . 25.0 111.04 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.12 -23.43 57.89 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.863 -0.523 . . . . 25.0 109.882 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 21.0 p -82.83 -7.53 59.65 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.57 35.19 17.33 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.568 0.747 . . . . 25.0 110.499 -173.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 60.63 36.04 19.75 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -177.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -118.71 131.25 56.14 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 122.067 -0.395 . . . . 25.0 110.65 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -61.61 -32.28 72.4 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 113.922 1.082 . . . . 25.0 113.922 -176.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -69.19 -9.98 55.53 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.821 0.674 . . . . 25.0 112.821 -178.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.731 ' HA ' HD13 ' A' ' 59' ' ' LEU . 11.4 m-85 -121.7 16.37 11.09 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 -178.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.79 -36.19 67.55 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.172 -0.955 . . . . 25.0 110.605 -177.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.8 mp0 -70.76 -16.63 62.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 122.088 0.947 . . . . 25.0 108.906 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.731 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -88.85 -2.36 58.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.095 -0.957 . . . . 25.0 108.902 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -112.1 -31.98 6.71 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -96.07 118.17 32.13 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.731 -0.606 . . . . 25.0 110.55 -178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.458 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.78 161.05 26.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.64 -0.709 . . . . 25.0 109.598 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.1 p -117.2 162.34 28.45 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 100.572 -3.862 . . . . 25.0 100.572 163.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.28 -4.96 14.75 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 116.756 -1.696 . . . . 25.0 115.972 -174.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -127.88 13.63 6.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.81 0.814 . . . . 25.0 111.022 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -77.81 -29.14 50.58 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.37 -0.831 . . . . 25.0 112.55 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.458 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.0 m95 -127.54 168.16 15.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 110.068 -0.345 . . . . 25.0 110.068 -178.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -67.94 120.94 15.03 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 106.6 -1.63 . . . . 25.0 106.6 171.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -95.8 104.76 16.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 100.358 -3.942 . . . . 25.0 100.358 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.83 134.95 53.14 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 114.857 -1.065 . . . . 25.0 110.986 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -90.05 99.86 12.79 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.56 -1.2 . . . . 25.0 107.925 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.3 mt -131.89 173.92 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 105.759 -1.941 . . . . 25.0 105.759 -176.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -116.51 168.95 9.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.576 0.703 . . . . 25.0 112.57 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.4 p -77.15 173.07 12.26 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 106.365 -1.717 . . . . 25.0 106.365 173.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.07 -162.23 33.64 Favored Glycine 0 C--O 1.241 0.546 0 C-N-CA 120.388 -0.911 . . . . 25.0 111.027 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.97 131.28 40.81 Favored 'Trans proline' 0 C--N 1.345 0.366 0 CA-C-N 118.869 1.334 . . . . 25.0 114.766 -175.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -138.17 161.39 36.95 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.8 p -104.85 152.03 23.11 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -139.31 101.01 4.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.969 -1.863 . . . . 25.0 105.969 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.91 110.16 22.2 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 122.063 0.935 . . . . 25.0 110.54 -178.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -93.96 147.69 22.87 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.28 -0.873 . . . . 25.0 110.113 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -125.34 110.13 13.62 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.741 -2.318 . . . . 25.0 104.741 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.0 mp -102.93 128.74 49.6 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.481 -0.782 . . . . 25.0 110.865 -171.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.8 t -85.58 3.9 38.59 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.105 0.479 . . . . 25.0 111.764 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.8 143.24 36.78 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.596 -0.52 . . . . 25.0 109.596 -177.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -84.13 -2.42 56.76 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.983 0.735 . . . . 25.0 112.983 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.97 158.76 24.61 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.075 0.769 . . . . 25.0 113.075 -176.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.7 t -75.78 155.97 34.98 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.367 1.247 . . . . 25.0 114.367 -172.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.5 t -103.37 155.98 18.08 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.6 -0.727 . . . . 25.0 109.615 177.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.4 t -117.79 -16.96 9.94 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 111.741 0.275 . . . . 25.0 111.741 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -171.34 154.31 3.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.069 0.461 . . . . 25.0 112.006 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -127.75 142.14 51.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 104.129 -2.545 . . . . 25.0 104.129 168.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -147.42 154.66 41.12 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.121 0.873 . . . . 25.0 108.93 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -137.91 139.01 39.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.888 -1.523 . . . . 25.0 106.888 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -148.9 164.33 34.82 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.573 0.624 . . . . 25.0 110.167 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.11 166.45 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 114.56 1.319 . . . . 25.0 114.56 -167.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 p -81.23 164.25 22.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.76 157.06 51.66 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 115.22 -0.9 . . . . 25.0 109.716 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -68.83 -20.07 39.94 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.891 -0.94 . . . . 25.0 114.535 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -120.96 32.02 6.14 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.228 0.455 . . . . 25.0 112.228 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.3 p-90 -74.95 164.86 26.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.694 0.759 . . . . 25.0 111.71 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -86.64 100.99 12.84 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.979 -1.01 . . . . 25.0 110.28 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -81.24 23.28 0.6 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 116.12 1.896 . . . . 25.0 116.12 -172.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.6 t -125.84 2.86 7.4 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.318 0.58 . . . . 25.0 110.482 175.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -108.69 157.02 37.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.329 -0.85 . . . . 25.0 109.477 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.4 153.21 78.13 Favored 'Trans proline' 0 C--N 1.348 0.539 0 O-C-N 121.943 0.444 . . . . 25.0 111.587 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.96 104.83 3.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.441 0.638 . . . . 25.0 112.313 -175.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.8 p -95.25 156.8 16.17 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.755 -0.831 . . . . 25.0 108.755 176.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -67.4 -25.17 65.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.3 0.571 . . . . 25.0 110.635 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.17 -25.13 63.29 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.277 -0.874 . . . . 25.0 111.858 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.4 t -85.05 -5.11 59.36 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.954 0.407 . . . . 25.0 111.807 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -103.11 153.83 19.91 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 114.993 1.479 . . . . 25.0 114.993 -174.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.35 90.02 4.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 102.604 -3.11 . . . . 25.0 102.604 163.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.0 -6.39 12.61 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.934 1.457 . . . . 25.0 114.934 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.2 t -80.13 132.68 59.17 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.165 -0.68 . . . . 25.0 109.165 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.8 149.8 48.72 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 114.94 -2.907 . . . . 25.0 110.82 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -102.63 -9.84 19.76 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.969 0.414 . . . . 25.0 111.425 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 54.5 m -150.36 67.89 0.97 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.451 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -89.02 132.88 34.55 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 118.87 -1.132 . . . . 25.0 108.788 175.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -121.68 99.06 6.25 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 104.166 -2.531 . . . . 25.0 104.166 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -89.65 92.11 8.94 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.134 -1.062 . . . . 25.0 108.134 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -109.17 118.28 36.33 Favored 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 107.428 -1.323 . . . . 25.0 107.428 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.69 80.87 0.42 Allowed Glycine 0 CA--C 1.501 -0.795 0 CA-C-N 115.568 -0.742 . . . . 25.0 112.963 -170.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.6 16.94 6.74 Favored Glycine 0 C--N 1.321 -0.289 0 C-N-CA 120.793 -0.717 . . . . 25.0 114.296 178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.15 104.88 3.2 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.967 -0.753 . . . . 25.0 108.967 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.2 mt -68.68 122.33 84.37 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.27 170.54 19.34 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 117.748 -1.035 . . . . 25.0 113.694 -175.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.424 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.84 29.09 6.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.356 -0.979 . . . . 25.0 108.356 176.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.16 -15.67 0.33 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 125.693 1.597 . . . . 25.0 112.152 -174.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.424 ' H ' ' C ' ' A' ' 128' ' ' ALA . 61.1 mt-30 -128.59 152.47 48.3 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 103.598 -2.742 . . . . 25.0 103.598 170.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.3 t -141.38 95.11 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 107.013 -1.477 . . . . 25.0 107.013 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -84.92 134.72 34.25 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 105.514 -2.032 . . . . 25.0 105.514 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.47 165.77 26.35 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 105.626 -1.99 . . . . 25.0 105.626 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -135.5 152.22 51.12 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 104.705 -2.331 . . . . 25.0 104.705 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.87 160.24 30.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.38 -1.341 . . . . 25.0 107.38 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -103.44 118.87 37.74 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.111 0.257 . . . . 25.0 110.924 -177.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.0 mt -76.87 132.57 71.11 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.06 146.25 96.25 Favored 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-O 121.818 0.674 . . . . 25.0 113.456 -178.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.75 -25.18 44.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.991 -1.004 . . . . 25.0 112.721 -169.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -84.48 7.98 18.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.682 -0.69 . . . . 25.0 110.119 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.6 mmt-85 -115.64 55.12 0.79 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 108.41 -0.959 . . . . 25.0 108.41 172.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.6 p -86.02 170.99 11.76 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.176 -1.787 . . . . 25.0 106.176 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.09 -169.53 44.15 Favored Glycine 0 C--N 1.32 -0.311 0 N-CA-C 115.64 1.016 . . . . 25.0 115.64 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.9 t -86.06 113.6 22.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.314 0.578 . . . . 25.0 110.86 -169.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.476 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 52.4 p-80 -159.92 171.78 18.79 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.956 -0.566 . . . . 25.0 111.049 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.6 p -105.01 151.16 7.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.348 -1.353 . . . . 25.0 107.348 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -134.63 128.33 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 N-CA-C 102.475 -3.157 . . . . 25.0 102.475 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.8 mp -113.12 131.74 55.72 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 116.067 -0.515 . . . . 25.0 109.659 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -112.73 131.22 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 25.0 109.565 -178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -127.55 142.91 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 122.064 0.935 . . . . 25.0 112.525 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -115.57 119.66 36.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.84 -1.527 . . . . 25.0 107.104 175.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -96.91 121.89 39.29 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.086 -1.079 . . . . 25.0 108.086 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 13.1 mm -77.66 143.2 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.002 -0.74 . . . . 25.0 109.002 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.63 -42.9 27.56 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.971 0.805 . . . . 25.0 109.792 175.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.01 -23.7 65.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 114.075 1.139 . . . . 25.0 114.075 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 45.4 p -139.02 168.82 18.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.967 0.889 . . . . 25.0 110.374 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.4 18.7 1.09 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.181 -0.918 . . . . 25.0 112.246 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -90.06 146.59 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.71 138.6 10.83 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.797 -1.927 . . . . 25.0 105.797 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -138.79 132.97 31.49 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.126 0.421 . . . . 25.0 112.032 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -93.18 115.03 27.67 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.653 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -97.05 112.63 24.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.204 -0.665 . . . . 25.0 109.204 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.1 139.12 37.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.915 -0.584 . . . . 25.0 112.163 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -126.45 135.24 64.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.327 -2.101 . . . . 25.0 105.327 166.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -93.67 132.67 37.8 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.614 -1.254 . . . . 25.0 107.614 176.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -133.23 161.69 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.539 0.57 . . . . 25.0 112.539 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -120.98 95.04 4.54 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.784 -2.302 . . . . 25.0 104.784 170.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.7 tp -93.53 160.0 14.98 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 114.157 1.169 . . . . 25.0 114.157 -170.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.3 p -145.9 173.03 12.5 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.567 -0.531 . . . . 25.0 109.567 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.74 0 N-CA-C 108.609 -0.886 . . . . 25.0 108.609 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 15.8 m170 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 121.304 0.573 . . . . 25.0 110.752 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.65 167.52 35.38 Favored Glycine 0 C--N 1.322 -0.218 1 N-CA-C 102.147 -4.381 . . . . 25.0 102.147 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -146.1 166.49 25.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 120.071 1.936 . . . . 25.0 109.915 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.89 124.03 63.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 107.814 -1.18 . . . . 25.0 107.814 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -40.53 56.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.767 -1.106 . . . . 25.0 110.384 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -153.28 128.21 4.81 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -65.55 134.59 21.38 Favored 'Cis proline' 0 C--N 1.347 0.482 0 CA-C-N 118.814 0.612 . . . . 25.0 110.88 -0.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.09 4.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.105 -0.498 . . . . 25.0 111.079 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.7 p -72.13 164.41 26.23 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -59.55 -22.46 61.73 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.183 0.516 . . . . 25.0 111.777 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.71 -52.93 25.55 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.05 -0.722 . . . . 25.0 109.05 175.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -67.37 -35.07 78.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.019 -0.537 . . . . 25.0 110.928 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -63.97 -32.15 73.58 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.061 -0.4 . . . . 25.0 110.739 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -40.48 96.44 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.418 0.628 . . . . 25.0 109.496 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.58 -34.31 76.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.022 -0.535 . . . . 25.0 110.362 178.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.5 mt -79.78 5.3 13.9 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.575 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.49 23.02 10.28 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.029 1.331 . . . . 25.0 113.233 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.474 ' C ' HD22 ' A' ' 19' ' ' ASN . 96.0 mt -88.18 -21.03 24.8 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.741 -1.207 . . . . 25.0 107.741 174.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.474 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.62 159.53 29.07 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 105.148 -2.168 . . . . 25.0 105.148 176.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.4 p -135.16 175.64 9.4 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 122.215 0.206 . . . . 25.0 110.517 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 71.46 5.06 5.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.75 1.759 . . . . 25.0 115.75 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -68.26 -38.95 82.28 Favored 'General case' 0 CA--C 1.501 -0.92 0 O-C-N 121.53 -0.731 . . . . 25.0 111.392 175.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.95 -64.21 1.57 Allowed Glycine 0 C--O 1.218 -0.869 0 O-C-N 123.575 0.547 . . . . 25.0 112.087 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -87.98 -53.29 4.81 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.581 1.181 . . . . 25.0 111.599 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.13 -7.97 9.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.017 -172.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.83 2.74 53.11 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.825 -0.547 . . . . 25.0 111.527 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -119.72 -33.98 3.88 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.949 -0.7 . . . . 25.0 109.98 172.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -126.98 103.9 23.34 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 110.102 -0.333 . . . . 25.0 110.102 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.98 -21.11 21.2 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 117.034 -1.511 . . . . 25.0 114.678 -175.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -84.99 12.89 6.72 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.0 m -66.79 -13.77 61.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.829 0.307 . . . . 25.0 111.829 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 27.8 m -65.72 135.94 27.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 113.654 0.983 . . . . 25.0 113.654 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -153.06 151.55 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -157.92 -172.08 24.65 Favored Glycine 0 C--N 1.328 0.115 0 N-CA-C 110.575 -1.01 . . . . 25.0 110.575 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 tp -127.62 148.29 50.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.011 0.906 . . . . 25.0 112.011 -177.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.63 156.97 33.69 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.008 -1.108 . . . . 25.0 108.008 172.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 134.85 2.36 3.14 Favored Glycine 0 C--O 1.224 -0.489 0 CA-C-N 114.832 -1.076 . . . . 25.0 113.285 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -75.78 141.44 72.06 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 121.536 -0.979 . . . . 25.0 109.757 -175.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -92.07 -18.37 12.98 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 N-CA-C 115.899 1.461 . . . . 25.0 115.899 -5.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -73.13 -35.19 66.47 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.043 1.497 . . . . 25.0 115.043 -168.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.93 38.23 3.72 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.16 -2.163 . . . . 25.0 105.16 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -111.9 -171.77 18.93 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 114.345 -1.298 . . . . 25.0 110.444 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.74 167.27 10.43 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.19 1.926 . . . . 25.0 114.739 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.02 159.97 31.09 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 106.727 -1.583 . . . . 25.0 106.727 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.11 139.24 57.62 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.287 -1.324 . . . . 25.0 108.914 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.49 -2.91 84.27 Favored Glycine 0 C--O 1.225 -0.415 0 CA-C-N 116.038 -0.528 . . . . 25.0 112.806 -175.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -124.5 11.73 8.63 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.473 -0.936 . . . . 25.0 108.473 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 59.5 mt -65.21 -54.35 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 112.61 0.596 . . . . 25.0 112.61 -171.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.26 -20.17 60.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.874 0.845 . . . . 25.0 108.798 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 t -74.56 -16.26 60.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.962 . . . . 25.0 111.792 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 55.26 26.24 8.3 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.38 0.672 . . . . 25.0 109.94 -172.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.57 35.78 22.66 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.781 1.232 . . . . 25.0 114.106 -176.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -122.3 133.97 54.67 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.183 0.593 . . . . 25.0 111.051 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -59.87 -31.96 70.26 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 115.092 1.515 . . . . 25.0 115.092 -175.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 55' ' ' THR . 0.6 OUTLIER -70.09 -10.25 58.13 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.191 0.441 . . . . 25.0 112.191 -179.249 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.676 ' HA ' HD13 ' A' ' 59' ' ' LEU . 8.4 m-85 -123.63 16.23 9.54 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -71.12 -41.59 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.058 -1.026 . . . . 25.0 111.613 -174.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 -73.43 -11.09 60.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.717 0.77 . . . . 25.0 109.722 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.676 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.9 mp -84.26 -6.61 59.42 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -114.83 -34.96 4.95 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.638 0.607 . . . . 25.0 112.638 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -89.42 113.5 24.85 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.651 -0.656 . . . . 25.0 111.094 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.0 pm0 -121.92 160.99 23.64 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.661 -0.7 . . . . 25.0 109.376 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -119.97 163.88 25.49 Favored Pre-proline 0 C--N 1.317 -0.825 1 N-CA-C 99.95 -4.093 . . . . 25.0 99.95 162.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.92 -5.78 17.11 Favored 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 116.196 -2.069 . . . . 25.0 115.669 -175.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -121.41 9.78 10.39 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.712 0.768 . . . . 25.0 111.115 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -77.78 -28.72 50.61 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.39 -0.819 . . . . 25.0 113.013 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 13.0 m95 -127.21 167.61 15.84 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.87 0.367 . . . . 25.0 111.717 -177.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -67.75 119.12 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 106.124 -1.806 . . . . 25.0 106.124 167.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -92.54 104.25 16.57 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 100.934 -3.728 . . . . 25.0 100.934 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.75 135.34 54.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.589 -1.187 . . . . 25.0 110.165 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -93.33 102.2 14.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 114.733 -1.121 . . . . 25.0 108.187 -177.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.6 mt -130.01 173.99 10.2 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.001 -1.111 . . . . 25.0 108.001 -176.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.46 156.89 26.05 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.55 -0.75 . . . . 25.0 111.562 -175.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.472 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.1 p -77.17 166.26 23.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.95 -1.5 . . . . 25.0 106.95 173.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 98.03 -164.5 21.57 Favored Glycine 0 C--O 1.239 0.454 0 N-CA-C 110.677 -0.969 . . . . 25.0 110.677 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -58.38 134.2 59.83 Favored 'Trans proline' 0 C--N 1.346 0.417 0 CA-C-N 118.972 1.386 . . . . 25.0 114.278 -177.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -140.84 161.66 37.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.309 -1.738 . . . . 25.0 106.309 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.2 p -105.4 152.12 23.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.837 -1.172 . . . . 25.0 107.837 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -139.45 101.02 4.13 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 105.967 -1.864 . . . . 25.0 105.967 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.39 108.77 20.15 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.79 0.805 . . . . 25.0 110.341 -178.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -97.75 148.67 23.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.602 -0.726 . . . . 25.0 110.094 -178.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -127.25 116.33 20.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 104.205 -2.517 . . . . 25.0 104.205 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -112.26 119.22 37.59 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.455 -0.793 . . . . 25.0 110.573 -173.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.01 18.58 3.48 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.507 0.67 . . . . 25.0 110.999 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.11 138.23 36.86 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.509 -0.552 . . . . 25.0 109.509 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -86.07 -7.15 58.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.488 0.922 . . . . 25.0 113.488 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.57 154.49 32.48 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.457 0.54 . . . . 25.0 112.457 -176.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.9 t -72.7 155.94 39.47 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.294 0.85 . . . . 25.0 113.294 -173.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.418 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.7 t -97.97 158.35 15.59 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.467 -0.938 . . . . 25.0 108.467 173.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.7 -14.98 10.17 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.041 0.213 . . . . 25.0 111.182 171.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -173.28 153.3 2.4 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.866 0.365 . . . . 25.0 111.826 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.07 139.08 54.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.225 -2.509 . . . . 25.0 104.225 166.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -143.08 148.18 36.24 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.476 -0.935 . . . . 25.0 108.476 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -137.92 132.36 32.29 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -149.52 164.01 36.25 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.65 0.659 . . . . 25.0 110.517 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.29 164.12 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -167.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.6 p -77.89 163.5 25.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -60.18 155.15 47.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.221 -0.899 . . . . 25.0 109.703 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -68.87 -23.01 35.56 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 117.404 -1.264 . . . . 25.0 113.633 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -113.09 32.07 5.99 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.607 0.363 . . . . 25.0 111.476 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.484 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 3.8 p-90 -82.28 163.06 22.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.674 0.75 . . . . 25.0 111.044 -177.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -93.28 100.98 13.23 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.096 -0.956 . . . . 25.0 110.574 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.484 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -74.01 19.92 0.11 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.817 1.784 . . . . 25.0 115.817 -175.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -112.52 -6.28 13.97 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 174.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -100.25 157.09 34.45 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.449 -0.796 . . . . 25.0 109.286 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 159.08 54.03 Favored 'Trans proline' 0 C--N 1.346 0.426 0 O-C-N 121.962 0.453 . . . . 25.0 112.241 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.98 99.95 1.89 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.076 0.465 . . . . 25.0 111.115 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.6 p -99.14 154.65 17.97 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.604 -0.887 . . . . 25.0 108.604 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -65.59 -25.62 67.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.255 0.55 . . . . 25.0 110.635 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.18 -25.19 63.31 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.392 -0.822 . . . . 25.0 111.973 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 30.8 t -89.6 -3.1 58.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.819 0.343 . . . . 25.0 111.597 -178.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -101.09 152.38 20.68 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.903 1.075 . . . . 25.0 113.903 -175.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -100.16 95.23 6.68 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 103.108 -2.923 . . . . 25.0 103.108 164.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -67.65 -6.4 20.32 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.195 1.183 . . . . 25.0 114.195 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.16 125.36 85.22 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 109.12 -0.696 . . . . 25.0 109.12 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -72.86 148.57 46.14 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 115.14 -2.773 . . . . 25.0 111.554 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -100.64 -14.77 18.0 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.5 m -147.35 64.42 1.15 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.568 -0.287 . . . . 25.0 111.101 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -89.08 138.59 31.28 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.457 -1.297 . . . . 25.0 108.825 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.59 99.54 6.05 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 103.552 -2.759 . . . . 25.0 103.552 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -92.09 91.87 8.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.692 -1.225 . . . . 25.0 107.692 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -110.25 118.03 35.26 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.223 -1.029 . . . . 25.0 108.223 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.67 80.46 0.46 Allowed Glycine 0 CA--C 1.502 -0.744 0 CA-C-N 115.459 -0.791 . . . . 25.0 113.791 -169.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.34 18.9 6.02 Favored Glycine 0 C--N 1.321 -0.263 0 C-N-CA 120.941 -0.647 . . . . 25.0 113.443 178.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.86 106.89 6.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.614 0.721 . . . . 25.0 109.427 177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.1 mt -70.73 122.7 87.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 105.834 -1.913 . . . . 25.0 105.834 176.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.5 169.24 21.39 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 118.125 -0.783 . . . . 25.0 113.94 -174.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.0 22.54 6.46 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.852 -0.613 . . . . 25.0 109.542 176.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.55 -17.46 0.28 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 125.716 1.607 . . . . 25.0 112.739 -176.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -128.96 150.06 50.55 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 103.172 -2.899 . . . . 25.0 103.172 168.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.9 t -140.33 94.99 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 38.1 m -89.64 121.5 31.88 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 174.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -132.33 166.95 20.76 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 107.63 -1.248 . . . . 25.0 107.63 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -132.83 155.73 48.45 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.432 -1.692 . . . . 25.0 106.432 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.48 160.53 23.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 47.7 m-20 -103.94 119.69 39.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.466 0.174 . . . . 25.0 110.57 -177.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.1 mt -76.69 131.06 74.69 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 107.117 -1.438 . . . . 25.0 107.117 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -63.65 145.92 91.88 Favored 'Trans proline' 0 C--N 1.352 0.751 0 CA-C-O 121.668 0.612 . . . . 25.0 113.384 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.83 -26.48 40.45 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.316 -0.856 . . . . 25.0 112.625 -169.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -82.38 7.11 14.97 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.6 -0.727 . . . . 25.0 110.275 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -118.59 51.82 1.07 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.268 -1.012 . . . . 25.0 108.268 172.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 9.3 p -85.89 170.99 11.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 106.086 -1.82 . . . . 25.0 106.086 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.01 -171.34 37.2 Favored Glycine 0 N--CA 1.452 -0.259 0 N-CA-C 115.444 0.937 . . . . 25.0 115.444 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.2 t -86.05 109.68 18.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.391 0.615 . . . . 25.0 110.512 -169.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.443 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.3 p-80 -158.26 171.06 20.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.974 -0.557 . . . . 25.0 111.941 -175.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.6 p -104.2 150.58 7.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.723 -1.214 . . . . 25.0 107.723 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.1 mt -133.25 121.92 43.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.6 132.91 52.06 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.608 -0.724 . . . . 25.0 109.78 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.25 135.23 53.27 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.193 -0.669 . . . . 25.0 109.193 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.98 144.6 37.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.922 0.868 . . . . 25.0 112.531 -176.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.418 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 13.3 t90 -113.28 112.37 23.6 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.121 -1.807 . . . . 25.0 106.121 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -92.62 125.23 37.15 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.035 -1.098 . . . . 25.0 108.035 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.0 mm -81.46 141.53 15.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 109.578 -0.527 . . . . 25.0 109.578 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.46 -43.05 24.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.868 0.758 . . . . 25.0 110.409 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.42 -23.92 64.69 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.611 0.967 . . . . 25.0 113.611 -172.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.4 p -138.86 169.99 16.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.912 0.863 . . . . 25.0 109.91 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.05 20.32 0.81 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.223 -0.899 . . . . 25.0 112.189 178.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -90.01 145.9 24.75 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.592 -0.693 . . . . 25.0 112.731 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.66 136.81 7.4 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.343 -1.725 . . . . 25.0 106.343 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -137.87 130.33 29.39 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.482 0.549 . . . . 25.0 112.482 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.07 117.59 28.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.65 -0.704 . . . . 25.0 110.605 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -97.13 115.91 28.39 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.801 -1.185 . . . . 25.0 107.801 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.95 142.97 27.59 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.8 136.7 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 104.505 -2.405 . . . . 25.0 104.505 166.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -99.47 129.83 45.68 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.0 m -133.5 162.19 40.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -116.03 95.05 4.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.912 -2.625 . . . . 25.0 103.912 166.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.77 163.09 14.59 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.104 -0.498 . . . . 25.0 112.164 -172.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.6 p -145.98 162.68 37.29 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.847 -0.797 . . . . 25.0 108.847 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.751 0 CA-C-O 118.005 -0.998 . . . . 25.0 111.05 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 m170 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.258 0.552 . . . . 25.0 110.967 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.54 169.98 40.01 Favored Glycine 0 CA--C 1.509 -0.333 1 N-CA-C 102.839 -4.104 . . . . 25.0 102.839 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -145.13 167.28 23.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.891 1.845 . . . . 25.0 109.3 177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.75 124.67 64.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.477 -0.935 . . . . 25.0 108.477 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -75.2 -43.5 51.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.661 -1.154 . . . . 25.0 109.96 -175.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.5 t -152.74 129.27 5.43 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 105.798 -1.927 . . . . 25.0 105.798 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -64.77 132.87 15.45 Favored 'Cis proline' 0 C--N 1.346 0.4 0 CA-C-N 118.791 0.604 . . . . 25.0 110.895 -0.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 109.67 2.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.039 -0.528 . . . . 25.0 111.953 -172.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 t -72.01 157.71 37.32 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 108.34 -0.985 . . . . 25.0 108.34 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -55.25 -25.25 32.46 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.562 0.745 . . . . 25.0 111.828 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.16 -53.52 36.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.659 0.742 . . . . 25.0 109.431 175.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -67.75 -35.04 78.01 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.714 -0.675 . . . . 25.0 110.626 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -63.56 -32.35 73.79 Favored 'General case' 0 C--O 1.218 -0.603 0 O-C-N 122.076 -0.39 . . . . 25.0 110.344 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -39.06 92.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 25.0 110.031 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -67.73 -35.81 79.43 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.058 -0.519 . . . . 25.0 109.821 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.7 mt -77.91 3.54 14.27 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.179 -0.464 . . . . 25.0 111.623 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 57.92 21.98 8.24 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.242 1.417 . . . . 25.0 113.245 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.472 ' C ' HD22 ' A' ' 19' ' ' ASN . 95.6 mt -84.05 -21.37 31.6 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 172.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.472 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.78 158.59 31.41 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 104.812 -2.292 . . . . 25.0 104.812 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.6 p -136.6 176.02 9.09 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.918 -0.401 . . . . 25.0 109.918 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 71.97 5.21 5.28 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.516 1.672 . . . . 25.0 115.516 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 78.6 m -68.54 -36.7 79.17 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 121.585 -0.697 . . . . 25.0 111.154 174.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -62.96 1.45 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.681 0.613 . . . . 25.0 112.378 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.3 t -87.97 -53.74 4.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 122.564 1.173 . . . . 25.0 111.868 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.2 t -67.36 -12.37 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.41 -1.268 . . . . 25.0 113.116 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.4 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 14.0 pt20 -87.02 -2.26 58.5 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 121.808 -0.557 . . . . 25.0 111.75 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -117.26 -34.53 4.31 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 119.744 -0.782 . . . . 25.0 110.424 172.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -127.04 98.52 30.21 Favored Pre-proline 0 C--O 1.24 0.597 0 N-CA-C 110.414 -0.217 . . . . 25.0 110.414 170.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -72.83 -20.68 22.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 116.976 -1.549 . . . . 25.0 114.734 -174.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -82.88 8.83 11.38 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.845 -0.534 . . . . 25.0 112.384 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m -67.68 -14.65 63.12 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.553 0.575 . . . . 25.0 112.553 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 m -64.16 133.05 30.05 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-O 121.703 0.763 . . . . 25.0 112.56 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -153.0 156.06 38.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 105.922 -1.881 . . . . 25.0 105.922 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.17 -169.04 23.89 Favored Glycine 0 N--CA 1.453 -0.167 0 N-CA-C 108.98 -1.648 . . . . 25.0 108.98 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -128.2 148.65 50.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.148 0.974 . . . . 25.0 111.474 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.82 157.05 31.44 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 107.473 -1.306 . . . . 25.0 107.473 172.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -3.47 2.19 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.751 -1.113 . . . . 25.0 112.484 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -75.89 145.5 77.88 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 108.397 -0.964 . . . . 25.0 108.397 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.75 -19.16 12.07 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 N-CA-C 116.255 1.598 . . . . 25.0 116.255 -4.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -76.61 -35.26 58.18 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.724 1.379 . . . . 25.0 114.724 -169.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -112.0 30.35 7.11 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -91.58 -176.22 43.01 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.349 -1.296 . . . . 25.0 110.978 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -62.24 171.15 5.54 Favored 'Trans proline' 0 C--O 1.241 0.626 0 C-N-CA 122.796 2.331 . . . . 25.0 113.934 178.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 159.97 30.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 106.859 -1.534 . . . . 25.0 106.859 174.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.77 138.17 58.13 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 107.192 -1.41 . . . . 25.0 107.192 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.39 85.67 Favored Glycine 0 C--O 1.229 -0.21 0 C-N-CA 121.468 -0.396 . . . . 25.0 112.962 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -124.92 10.9 8.29 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.742 -0.466 . . . . 25.0 109.742 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 63.3 mt -64.95 -49.15 81.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 122.217 -0.302 . . . . 25.0 111.486 -173.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.24 -21.22 56.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.073 0.463 . . . . 25.0 109.898 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.7 p -83.46 -8.65 59.33 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.569 0.581 . . . . 25.0 112.569 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.63 32.6 12.09 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.556 0.742 . . . . 25.0 110.176 -172.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.34 38.28 25.89 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.727 1.38 . . . . 25.0 114.727 -176.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.54 137.02 54.61 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.023 0.529 . . . . 25.0 110.942 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.41 -35.78 80.3 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 115.135 1.532 . . . . 25.0 115.135 -174.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -70.95 -7.18 44.16 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.529 0.566 . . . . 25.0 112.529 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.5 m-85 -121.47 11.96 10.74 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -72.55 -35.25 67.97 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.891 -1.131 . . . . 25.0 110.218 -175.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.9 mp0 -70.83 -16.05 62.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.889 0.852 . . . . 25.0 109.576 174.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.82 -3.8 58.91 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.789 -0.819 . . . . 25.0 108.789 -177.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -115.1 -32.13 5.81 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.293 0.479 . . . . 25.0 112.293 173.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -91.64 118.08 30.31 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 121.496 -0.752 . . . . 25.0 109.854 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.451 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.9 pm0 -124.06 161.0 26.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.921 -0.581 . . . . 25.0 110.13 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -120.0 162.71 31.97 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 100.25 -3.981 . . . . 25.0 100.25 163.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.06 -7.17 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.775 -1.683 . . . . 25.0 115.786 -175.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 12.0 t -125.18 10.73 8.12 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.225 0.536 . . . . 25.0 112.018 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -77.32 -28.47 53.19 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.723 -0.61 . . . . 25.0 112.551 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.451 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 12.3 m95 -125.11 165.85 17.47 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 120.656 0.265 . . . . 25.0 110.814 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -68.83 120.97 15.6 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.97 -1.863 . . . . 25.0 105.97 170.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -94.48 103.87 15.83 Favored 'General case' 0 CA--C 1.499 -1.007 1 N-CA-C 99.997 -4.075 . . . . 25.0 99.997 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -66.19 134.58 53.02 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.024 -0.989 . . . . 25.0 110.512 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -91.83 99.42 12.29 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.715 -1.217 . . . . 25.0 107.715 -178.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.2 mt -130.9 173.94 10.47 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.275 -1.75 . . . . 25.0 106.275 -176.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -113.4 163.73 14.5 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.786 1.032 . . . . 25.0 113.786 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.487 HG22 HD23 ' A' ' 168' ' ' LEU . 77.9 p -77.05 170.81 15.86 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.745 -1.57 . . . . 25.0 106.953 175.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.09 -161.72 29.32 Favored Glycine 0 C--O 1.241 0.581 0 N-CA-C 111.144 -0.782 . . . . 25.0 111.144 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.68 131.34 41.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 118.935 1.368 . . . . 25.0 114.132 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -138.01 160.48 39.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.342 -1.725 . . . . 25.0 106.342 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.3 p -99.39 150.35 22.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.527 -1.286 . . . . 25.0 107.527 178.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -137.61 100.98 4.35 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 105.54 -2.022 . . . . 25.0 105.54 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.68 112.57 25.33 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.367 -0.833 . . . . 25.0 109.988 -178.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.3 m95 -101.7 151.65 21.78 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 25.0 110.051 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -128.61 114.33 16.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 104.89 -2.263 . . . . 25.0 104.89 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -116.8 117.98 31.26 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.8 0.84 . . . . 25.0 112.085 -173.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.72 -32.71 69.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.454 0.645 . . . . 25.0 109.828 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.96 106.08 17.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 25.0 110.704 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -70.09 -0.12 7.11 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 115.161 1.541 . . . . 25.0 115.161 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -71.34 158.32 36.55 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.607 0.241 . . . . 25.0 111.613 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.2 t -67.79 156.09 37.82 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 116.053 1.872 . . . . 25.0 116.053 -170.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.437 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 14.5 t -99.1 161.05 13.84 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 114.856 -1.066 . . . . 25.0 108.241 172.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 t -117.97 -15.48 9.95 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.114 0.259 . . . . 25.0 111.081 170.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 t -172.81 155.39 3.18 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.965 0.412 . . . . 25.0 111.793 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 57.6 m95 -126.67 137.44 53.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 105.137 -2.171 . . . . 25.0 105.137 166.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -139.87 146.15 38.94 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.447 -0.945 . . . . 25.0 108.447 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -137.47 133.7 34.94 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.543 -1.651 . . . . 25.0 106.543 -176.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.99 161.49 42.23 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.557 0.617 . . . . 25.0 110.562 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.4 163.13 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 114.145 1.165 . . . . 25.0 114.145 -168.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.1 p -77.71 159.85 28.83 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.216 -1.031 . . . . 25.0 108.216 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -62.74 157.66 57.29 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.909 -1.042 . . . . 25.0 109.575 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -69.59 -18.24 37.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 N-CA-C 114.861 1.062 . . . . 25.0 114.861 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -118.73 31.85 6.44 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.615 0.366 . . . . 25.0 111.985 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -76.72 163.17 27.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.723 0.773 . . . . 25.0 111.5 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -85.95 101.31 12.78 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.899 -1.046 . . . . 25.0 110.297 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.82 21.67 0.66 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 116.059 1.874 . . . . 25.0 116.059 -173.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.0 t -125.36 0.42 7.69 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.475 0.655 . . . . 25.0 109.669 173.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -103.61 158.81 31.08 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.478 -0.934 . . . . 25.0 108.478 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.62 156.01 67.69 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 121.863 0.401 . . . . 25.0 112.66 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.76 100.87 1.58 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.964 0.412 . . . . 25.0 111.817 -178.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 57.8 p -94.14 152.66 18.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -66.21 -25.17 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.342 0.592 . . . . 25.0 110.804 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.76 -24.61 63.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.348 -0.842 . . . . 25.0 112.093 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.9 t -83.35 -5.24 59.08 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.709 0.29 . . . . 25.0 111.777 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -102.94 154.02 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.344 1.238 . . . . 25.0 114.344 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -95.33 96.46 9.16 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 103.167 -2.901 . . . . 25.0 103.167 164.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.1 mt -69.01 -6.67 29.38 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -171.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.46 123.0 83.15 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 108.57 -0.9 . . . . 25.0 108.57 176.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 139.54 35.07 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 115.059 -2.827 . . . . 25.0 112.148 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -92.2 -12.51 32.56 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.266 0.469 . . . . 25.0 112.266 -176.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.3 m -147.58 66.88 1.12 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.317 -0.401 . . . . 25.0 110.071 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.01 135.05 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 118.727 -1.189 . . . . 25.0 108.978 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -125.18 99.39 6.07 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.895 -2.631 . . . . 25.0 103.895 178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -91.16 91.91 8.44 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 106.694 -1.595 . . . . 25.0 106.694 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -111.76 116.99 31.62 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.114 0.959 . . . . 25.0 108.568 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.73 81.58 0.43 Allowed Glycine 0 CA--C 1.501 -0.818 0 CA-C-N 115.004 -0.998 . . . . 25.0 112.312 -172.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 121.14 15.04 4.81 Favored Glycine 0 C--O 1.228 -0.276 0 C-N-CA 120.867 -0.682 . . . . 25.0 114.086 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.01 104.06 5.44 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.266 -1.013 . . . . 25.0 108.266 176.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.4 mt -78.74 122.06 84.29 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 107.62 -1.252 . . . . 25.0 107.62 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.0 160.84 42.32 Favored 'Trans proline' 0 C--N 1.347 0.451 0 CA-C-O 121.505 0.544 . . . . 25.0 113.478 -177.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.98 31.95 3.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.78 -4.58 1.66 Allowed 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 113.618 -1.628 . . . . 25.0 111.435 -174.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.06 152.33 48.71 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 104.438 -2.43 . . . . 25.0 104.438 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.5 t -141.39 95.09 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.221 -1.77 . . . . 25.0 106.221 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.8 t -85.43 140.98 30.29 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 104.69 -2.337 . . . . 25.0 104.69 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -156.98 166.91 32.02 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.81 -1.541 . . . . 25.0 108.705 -176.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -134.11 157.57 45.82 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.17 160.49 30.2 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.153 -1.425 . . . . 25.0 107.153 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -105.61 115.55 30.44 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.068 0.23 . . . . 25.0 111.034 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.2 mt -77.38 132.62 69.24 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 108.058 -1.09 . . . . 25.0 108.058 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.69 146.5 96.69 Favored 'Trans proline' 0 C--N 1.353 0.791 0 N-CA-C 113.766 0.641 . . . . 25.0 113.766 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -82.2 -25.78 33.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.164 -0.925 . . . . 25.0 112.768 -170.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -83.83 9.83 11.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.684 0.754 . . . . 25.0 110.115 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.2 mmt-85 -116.31 58.08 0.76 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.221 -1.029 . . . . 25.0 108.221 172.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.2 p -86.0 170.85 11.9 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 107.551 -1.278 . . . . 25.0 107.551 175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 81.89 -163.25 43.59 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.851 1.101 . . . . 25.0 115.851 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.1 t -85.71 107.45 17.59 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.288 0.566 . . . . 25.0 110.693 -168.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.441 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 47.1 p-80 -156.29 169.71 23.93 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.018 -0.537 . . . . 25.0 111.32 -177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -107.74 151.27 9.84 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 N-CA-C 108.065 -1.087 . . . . 25.0 108.065 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.42 120.8 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.14 -2.17 . . . . 25.0 105.14 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -105.18 138.59 41.15 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.513 -0.767 . . . . 25.0 109.955 179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -131.84 140.29 49.09 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.166 -0.679 . . . . 25.0 109.166 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -128.59 140.37 49.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.879 0.847 . . . . 25.0 112.358 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.437 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 16.6 t90 -103.42 113.12 26.37 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.395 -1.705 . . . . 25.0 106.395 173.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -94.48 119.95 33.97 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.4 mm -76.92 142.05 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 O-C-N 122.162 -0.336 . . . . 25.0 110.157 -177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.72 -44.34 20.96 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.551 0.691 . . . . 25.0 110.177 174.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.07 -24.63 65.08 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.778 1.399 . . . . 25.0 114.778 -172.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.6 p -139.26 170.8 15.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 122.142 0.972 . . . . 25.0 110.648 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 18.79 1.25 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.883 -1.053 . . . . 25.0 112.386 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -89.94 148.87 22.86 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.727 -0.608 . . . . 25.0 112.172 -176.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.29 143.0 10.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.619 -1.993 . . . . 25.0 105.619 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -146.83 133.8 20.26 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.192 0.441 . . . . 25.0 112.192 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -92.41 115.87 28.47 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.838 -0.619 . . . . 25.0 111.481 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -97.0 122.77 40.36 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.232 -1.025 . . . . 25.0 108.232 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -98.13 143.61 28.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.291 -0.413 . . . . 25.0 111.771 -177.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -125.72 136.49 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 106.144 -1.799 . . . . 25.0 106.144 167.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -97.06 130.58 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.6 -1.259 . . . . 25.0 107.6 176.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.74 162.66 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.904 0.705 . . . . 25.0 112.904 -174.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -120.79 95.07 4.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 104.964 -2.235 . . . . 25.0 104.964 168.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.487 HD23 HG22 ' A' ' 74' ' ' THR . 2.1 tp -92.31 158.83 15.89 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.259 1.207 . . . . 25.0 114.259 -169.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 75.3 p -145.9 165.35 29.2 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.622 -0.51 . . . . 25.0 109.622 176.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.76 0 CA-C-O 118.745 -0.645 . . . . 25.0 110.29 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.3 m80 . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 121.739 0.78 . . . . 25.0 110.429 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.98 167.24 31.83 Favored Glycine 0 C--N 1.318 -0.449 1 N-CA-C 100.05 -5.22 . . . . 25.0 100.05 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -144.25 158.61 43.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 120.484 2.142 . . . . 25.0 110.732 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.52 118.94 36.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 106.428 -1.693 . . . . 25.0 106.428 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -75.91 -41.25 52.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.166 -1.379 . . . . 25.0 109.608 -174.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.3 t -153.97 129.01 4.93 Favored Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 105.745 -1.946 . . . . 25.0 105.745 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HB2' HD13 ' A' ' 164' ' ' ILE . 65.3 Cg_endo -64.37 131.54 12.0 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.991 0.83 . . . . 25.0 111.316 -0.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 114.18 5.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.975 -0.557 . . . . 25.0 112.396 -172.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.0 t -71.98 158.0 36.8 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -55.78 -24.31 34.94 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.264 0.626 . . . . 25.0 111.822 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.79 -54.12 36.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.82 0.819 . . . . 25.0 109.288 175.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -69.03 -34.49 75.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.398 -0.819 . . . . 25.0 110.741 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.44 -33.35 75.36 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.98 -0.45 . . . . 25.0 110.517 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -39.9 95.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.243 0.545 . . . . 25.0 109.873 177.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -66.32 -36.5 83.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.222 0.534 . . . . 25.0 110.061 177.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.4 mt -77.27 4.87 9.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.41 176.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.53 24.11 11.55 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.309 1.444 . . . . 25.0 112.647 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.7 mt -88.6 -21.38 24.05 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.841 -1.17 . . . . 25.0 107.841 174.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.455 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.95 159.21 28.78 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 106.613 -1.625 . . . . 25.0 106.613 178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.2 p -132.86 175.48 9.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 122.597 0.359 . . . . 25.0 110.221 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 68.44 5.26 4.68 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.813 1.782 . . . . 25.0 115.813 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.7 m -68.16 -41.08 82.07 Favored 'General case' 0 CA--C 1.501 -0.91 0 O-C-N 121.299 -0.876 . . . . 25.0 111.017 173.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.67 -63.84 1.87 Allowed Glycine 0 C--O 1.218 -0.872 0 O-C-N 123.599 0.562 . . . . 25.0 111.93 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.5 t -87.94 -51.82 5.61 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 122.291 1.043 . . . . 25.0 112.043 -177.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.7 OUTLIER -66.97 -13.25 16.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 114.867 -1.06 . . . . 25.0 113.141 -172.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.86 -4.1 58.41 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.735 -0.603 . . . . 25.0 111.514 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -115.01 -34.03 5.21 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.419 -0.513 . . . . 25.0 110.322 174.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -126.95 95.57 36.73 Favored Pre-proline 0 C--O 1.243 0.754 0 CA-C-O 120.664 0.269 . . . . 25.0 110.412 171.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HA ' HG12 ' A' ' 25' ' ' VAL . 95.7 Cg_endo -72.51 -19.44 24.84 Favored 'Trans proline' 0 C--N 1.346 0.413 0 N-CA-C 115.097 1.153 . . . . 25.0 115.097 -174.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -91.34 14.14 15.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.788 0.662 . . . . 25.0 112.788 -176.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 54.3 m -62.89 -18.7 63.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.15 -0.477 . . . . 25.0 112.233 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.7 m -64.08 116.55 3.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 115.191 1.552 . . . . 25.0 115.191 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -153.09 157.44 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.15 -169.24 22.25 Favored Glycine 0 C--O 1.229 -0.168 0 N-CA-C 108.054 -2.018 . . . . 25.0 108.054 -177.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 tp -112.3 147.43 36.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.493 1.147 . . . . 25.0 112.301 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.76 156.97 31.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.676 -1.231 . . . . 25.0 107.676 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.92 -1.72 2.88 Favored Glycine 0 C--O 1.224 -0.501 0 CA-C-N 114.706 -1.134 . . . . 25.0 112.351 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -75.91 144.82 76.76 Favored Pre-proline 0 C--N 1.321 -0.649 0 O-C-N 121.664 -0.904 . . . . 25.0 110.073 -176.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -91.39 -18.07 14.67 Favored 'Cis proline' 0 CA--C 1.542 0.9 0 N-CA-C 115.585 1.34 . . . . 25.0 115.585 -6.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.46 -36.3 60.7 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 115.124 1.528 . . . . 25.0 115.124 -168.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.61 40.82 2.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.35 -167.58 16.69 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 114.541 -1.209 . . . . 25.0 111.219 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -59.79 168.27 5.84 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 123.1 2.533 . . . . 25.0 114.052 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.03 160.03 31.02 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 106.872 -1.529 . . . . 25.0 106.872 173.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -57.93 140.81 51.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.784 -1.098 . . . . 25.0 108.443 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.94 -4.05 81.68 Favored Glycine 0 C--O 1.225 -0.41 0 CA-C-N 116.012 -0.54 . . . . 25.0 113.091 -175.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -124.25 10.33 8.66 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.456 -0.942 . . . . 25.0 108.456 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.6 mt -68.45 -51.27 48.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 O-C-N 122.311 -0.243 . . . . 25.0 111.25 -173.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.49 -20.23 60.73 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.886 -0.509 . . . . 25.0 109.772 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 p -84.21 -10.34 57.79 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.388 0.514 . . . . 25.0 112.388 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.42 36.15 15.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.631 0.772 . . . . 25.0 110.136 -171.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.4 t0 61.03 34.01 19.43 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.834 1.42 . . . . 25.0 114.834 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -119.26 135.2 54.81 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.952 -0.468 . . . . 25.0 111.658 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.8 p -61.05 -35.93 78.24 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -72.15 -7.27 48.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.239 0.542 . . . . 25.0 112.408 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.681 ' HA ' HD13 ' A' ' 59' ' ' LEU . 15.2 m-85 -120.39 12.26 11.63 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 107.024 -1.473 . . . . 25.0 107.024 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -72.23 -34.67 68.48 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.151 -0.968 . . . . 25.0 110.117 -175.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.3 mp0 -70.09 -17.3 63.21 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 122.023 0.916 . . . . 25.0 110.011 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.681 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.2 -4.98 59.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.632 -0.877 . . . . 25.0 108.632 -176.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -113.17 -32.06 6.43 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.096 0.474 . . . . 25.0 111.783 173.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -93.89 115.58 27.97 Favored 'General case' 0 C--N 1.322 -0.627 0 O-C-N 121.721 -0.612 . . . . 25.0 110.388 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.438 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -126.6 161.0 29.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.163 0.506 . . . . 25.0 109.792 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 13.3 p -118.2 161.99 32.14 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 100.45 -3.907 . . . . 25.0 100.45 162.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -70.02 -1.65 9.04 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 116.983 -1.545 . . . . 25.0 115.852 -174.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.7 t -127.97 12.57 6.72 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.734 0.778 . . . . 25.0 111.031 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -78.96 -30.06 44.3 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.306 -0.871 . . . . 25.0 113.121 -176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.438 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.1 m95 -124.81 165.23 18.38 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 110.309 -0.256 . . . . 25.0 110.309 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -66.44 127.62 33.0 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.454 -2.054 . . . . 25.0 105.454 170.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -101.68 107.96 19.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 100.418 -3.919 . . . . 25.0 100.418 178.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.19 135.37 53.38 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.915 -1.039 . . . . 25.0 110.139 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -90.41 100.89 13.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 107.596 -1.261 . . . . 25.0 107.596 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.1 mt -130.24 173.94 10.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.756 -1.572 . . . . 25.0 106.756 -176.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -115.26 166.46 11.83 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.654 0.74 . . . . 25.0 112.811 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.425 HG21 ' HA ' ' A' ' 139' ' ' ALA . 75.3 p -77.04 171.02 15.47 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.461 -1.681 . . . . 25.0 106.461 173.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 87.36 -162.53 33.49 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 120.585 -0.817 . . . . 25.0 111.452 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.57 131.29 39.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 CA-C-N 118.82 1.31 . . . . 25.0 114.628 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -136.07 159.34 42.01 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.693 -1.966 . . . . 25.0 105.693 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.1 p -99.18 151.01 21.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.307 -1.368 . . . . 25.0 107.307 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -138.72 101.05 4.23 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.8 122.69 46.26 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.481 -0.933 . . . . 25.0 108.481 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 63.3 m95 -108.22 147.51 31.26 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.8 -1.091 . . . . 25.0 109.399 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -126.73 115.12 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.089 -2.559 . . . . 25.0 104.089 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -113.91 132.91 55.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.384 -0.825 . . . . 25.0 111.411 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.8 t -93.06 6.15 48.97 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.428 0.632 . . . . 25.0 109.992 173.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -118.48 138.33 52.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.026 0.441 . . . . 25.0 110.431 -177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -91.19 -9.19 46.3 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 112.635 0.606 . . . . 25.0 112.635 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -68.1 157.38 35.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.259 0.466 . . . . 25.0 112.259 -176.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.1 t -75.59 155.97 35.41 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 114.631 1.345 . . . . 25.0 114.631 -172.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.3 t -97.63 158.91 15.24 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.198 -0.91 . . . . 25.0 108.664 173.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -118.02 -15.24 9.94 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.149 0.281 . . . . 25.0 111.63 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 t -171.89 154.13 3.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.009 0.433 . . . . 25.0 111.507 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -127.13 142.01 51.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.537 -2.394 . . . . 25.0 104.537 167.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -147.12 154.57 41.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.668 -0.864 . . . . 25.0 108.668 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -137.96 136.79 37.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 106.379 -1.712 . . . . 25.0 106.379 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.98 161.87 41.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.284 0.493 . . . . 25.0 110.065 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.88 165.79 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 113.927 1.084 . . . . 25.0 113.927 -167.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.2 p -79.94 161.13 25.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.208 -1.034 . . . . 25.0 108.208 169.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.72 158.88 38.4 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.197 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.07 -19.15 39.78 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 117.4 -1.267 . . . . 25.0 114.231 -174.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -120.81 31.92 6.2 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 122.764 0.426 . . . . 25.0 111.554 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.493 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.7 p-90 -73.68 164.39 26.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.934 0.874 . . . . 25.0 112.68 -177.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.18 101.0 10.92 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.657 -1.156 . . . . 25.0 109.847 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.493 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.2 15.96 5.69 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.656 2.095 . . . . 25.0 116.656 -169.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.5 t -125.57 9.01 7.71 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.754 0.788 . . . . 25.0 109.12 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.7 156.18 41.92 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 114.585 -1.189 . . . . 25.0 107.943 -174.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -66.74 155.43 70.54 Favored 'Trans proline' 0 CA--C 1.531 0.372 0 O-C-N 121.953 0.449 . . . . 25.0 111.673 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.41 101.09 2.83 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.587 0.708 . . . . 25.0 112.269 -175.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.9 p -89.59 155.9 18.95 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.255 -1.017 . . . . 25.0 108.255 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -64.34 -26.64 68.56 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.916 -0.49 . . . . 25.0 111.232 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.05 -25.13 63.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.583 -0.735 . . . . 25.0 112.464 177.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.8 t -79.44 -10.31 59.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.078 0.399 . . . . 25.0 112.078 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -99.4 155.87 17.31 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 114.323 1.231 . . . . 25.0 114.323 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -94.0 94.98 8.75 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 102.251 -3.24 . . . . 25.0 102.251 161.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.5 mt -66.18 -6.39 13.36 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 114.812 1.412 . . . . 25.0 114.812 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.5 t -85.75 127.51 62.39 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 108.602 -0.888 . . . . 25.0 108.602 176.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.44 150.3 57.79 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 115.644 -2.437 . . . . 25.0 111.459 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -101.72 -7.79 22.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.095 0.474 . . . . 25.0 111.362 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 57.3 m -148.67 68.95 1.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 25.0 109.764 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -89.08 125.37 34.99 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.705 -0.85 . . . . 25.0 108.705 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -118.92 98.92 6.43 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 105.058 -2.201 . . . . 25.0 105.058 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -87.96 92.05 8.99 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.019 -0.734 . . . . 25.0 109.019 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -109.67 118.83 37.59 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 106.814 -1.55 . . . . 25.0 106.814 174.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.54 82.51 0.34 Allowed Glycine 0 CA--C 1.5 -0.869 0 CA-C-N 115.601 -0.727 . . . . 25.0 112.862 -169.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.03 16.37 6.26 Favored Glycine 0 C--N 1.321 -0.293 0 C-N-CA 120.982 -0.628 . . . . 25.0 113.151 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.05 103.94 4.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 121.564 0.697 . . . . 25.0 109.525 177.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.67 125.29 91.3 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 106.164 -1.791 . . . . 25.0 106.164 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.53 167.47 26.47 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 118.197 -0.736 . . . . 25.0 113.749 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.73 26.95 4.68 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.843 -1.169 . . . . 25.0 107.843 175.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.71 -10.15 0.62 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.82 1.648 . . . . 25.0 111.656 -173.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.4 mt-30 -131.02 152.38 50.38 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 103.838 -2.652 . . . . 25.0 103.838 170.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -141.49 94.95 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 106.421 -1.696 . . . . 25.0 106.421 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -88.14 140.94 28.98 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 104.749 -2.315 . . . . 25.0 104.749 173.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.7 166.92 27.92 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.101 -1.814 . . . . 25.0 106.101 -177.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -134.49 152.96 52.13 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.722 -2.325 . . . . 25.0 104.722 172.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -158.56 158.86 34.76 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.515 -1.291 . . . . 25.0 107.515 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -105.29 116.58 32.19 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.247 0.342 . . . . 25.0 111.408 -174.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 57.7 mt -77.68 131.94 69.69 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -61.64 147.1 96.16 Favored 'Trans proline' 0 C--N 1.353 0.763 0 N-CA-C 113.762 0.639 . . . . 25.0 113.762 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.425 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.74 -27.26 40.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.079 -0.964 . . . . 25.0 112.696 -169.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -83.99 9.77 11.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.62 -0.718 . . . . 25.0 110.185 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -116.2 50.42 1.04 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 108.841 -0.8 . . . . 25.0 108.841 172.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 42.3 p -86.07 160.49 19.28 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.526 -1.657 . . . . 25.0 106.526 175.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 94.4 -168.49 28.24 Favored Glycine 0 C--O 1.237 0.326 0 N-CA-C 114.285 0.474 . . . . 25.0 114.285 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.5 t -86.14 114.89 23.35 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.352 0.596 . . . . 25.0 111.181 -169.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 50.9 p-80 -160.0 171.7 18.87 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.75 -0.659 . . . . 25.0 110.257 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -107.15 151.6 8.99 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 107.757 -1.201 . . . . 25.0 107.757 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.1 mt -132.93 121.9 45.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.57 129.87 52.6 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.635 -0.712 . . . . 25.0 109.748 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -114.6 130.82 56.82 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 108.973 -0.751 . . . . 25.0 108.973 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 1.7 p -125.46 137.55 57.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 122.043 0.925 . . . . 25.0 112.637 -177.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -111.92 118.46 35.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.77 -1.559 . . . . 25.0 106.954 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -98.63 125.31 43.87 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.539 -0.911 . . . . 25.0 108.539 178.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 21.7 mm -80.55 141.59 15.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.309 -0.626 . . . . 25.0 109.309 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.35 21.65 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.723 0.692 . . . . 25.0 110.476 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.01 -23.72 65.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.993 1.108 . . . . 25.0 113.993 -171.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.2 p -138.95 168.62 19.42 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.958 0.885 . . . . 25.0 110.248 -174.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.76 28.74 0.33 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.348 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -99.11 145.78 26.8 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.964 0.727 . . . . 25.0 112.964 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.3 146.13 15.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.279 -2.119 . . . . 25.0 105.279 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -148.16 138.11 22.52 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 111.87 0.322 . . . . 25.0 111.87 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.03 113.22 25.02 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 123.735 0.647 . . . . 25.0 111.205 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -97.06 111.9 23.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.981 -0.748 . . . . 25.0 108.981 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.42 141.13 30.19 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.467 0.543 . . . . 25.0 112.467 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . 0.418 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.3 tt -125.94 135.45 63.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 105.637 -1.986 . . . . 25.0 105.637 166.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -94.43 131.63 39.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.17 -1.419 . . . . 25.0 107.17 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.8 m -132.17 162.01 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.807 0.669 . . . . 25.0 112.807 -175.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -119.74 95.0 4.59 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.392 -2.447 . . . . 25.0 104.392 169.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.17 162.75 14.53 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 112.903 0.705 . . . . 25.0 112.903 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.4 p -145.92 161.1 40.81 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.425 -0.954 . . . . 25.0 108.425 174.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.888 -0.577 . . . . 25.0 110.558 -178.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.476 0.655 . . . . 25.0 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.17 168.99 37.14 Favored Glycine 0 CA--C 1.509 -0.293 1 N-CA-C 101.691 -4.564 . . . . 25.0 101.691 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.4 p90 -146.83 165.06 30.84 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 120.318 2.059 . . . . 25.0 110.583 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.65 123.33 57.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.199 -1.037 . . . . 25.0 108.199 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.09 -43.08 55.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.63 -1.168 . . . . 25.0 109.883 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 t -154.24 129.2 4.94 Favored Pre-proline 0 C--N 1.321 -0.666 0 N-CA-C 106.35 -1.722 . . . . 25.0 106.35 177.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.404 ' HB2' HD13 ' A' ' 164' ' ' ILE . 67.3 Cg_endo -65.17 131.25 12.46 Favored 'Cis proline' 0 CA--C 1.532 0.418 0 C-N-CA 128.903 0.793 . . . . 25.0 110.92 -0.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.93 112.4 4.3 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.023 -0.535 . . . . 25.0 112.129 -172.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.9 t -72.23 157.84 36.98 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 107.566 -1.272 . . . . 25.0 107.566 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -55.48 -25.06 34.72 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.138 0.575 . . . . 25.0 112.238 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.61 -53.48 46.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.807 0.813 . . . . 25.0 109.447 175.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -70.39 -32.46 70.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.63 -0.714 . . . . 25.0 110.925 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -63.51 -32.4 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 121.847 -0.533 . . . . 25.0 110.374 178.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -40.3 96.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.38 0.609 . . . . 25.0 109.47 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -66.18 -36.15 82.32 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.887 -0.597 . . . . 25.0 110.206 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -78.24 5.3 10.6 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 25.0 111.518 177.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 58.35 24.45 11.66 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.158 1.383 . . . . 25.0 112.69 -179.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 19' ' ' ASN . 94.6 mt -89.74 -21.65 22.57 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.933 -1.136 . . . . 25.0 107.933 174.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.464 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -122.93 159.12 28.94 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 106.581 -1.637 . . . . 25.0 106.581 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.2 p -133.04 176.51 8.43 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.033 -0.358 . . . . 25.0 110.033 -175.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 71.94 0.09 3.41 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.624 1.713 . . . . 25.0 115.624 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.1 m -65.95 -43.33 88.29 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 121.633 -0.667 . . . . 25.0 111.745 175.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.73 -63.24 1.94 Allowed Glycine 0 C--O 1.218 -0.891 0 O-C-N 123.598 0.561 . . . . 25.0 111.939 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -87.67 -51.46 5.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.989 0.899 . . . . 25.0 111.857 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.3 t -66.66 -13.2 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.177 -0.92 . . . . 25.0 113.235 -172.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -84.87 -4.99 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 121.436 -0.79 . . . . 25.0 111.857 178.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -112.56 -34.07 5.95 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.515 -0.55 . . . . 25.0 109.515 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.3 100.45 29.46 Favored Pre-proline 0 CA--C 1.538 0.51 0 N-CA-C 109.399 -0.593 . . . . 25.0 109.399 172.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.1 -19.87 22.34 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 117.758 -1.028 . . . . 25.0 113.793 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -88.82 15.78 7.85 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.187 0.439 . . . . 25.0 112.187 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 71.2 m -63.22 -23.13 67.29 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.978 0.418 . . . . 25.0 111.585 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 4.4 m -64.04 122.0 14.1 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 115.371 1.619 . . . . 25.0 115.371 -175.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -152.88 159.04 42.98 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.186 -1.783 . . . . 25.0 106.186 174.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.03 -165.48 17.02 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 108.333 -1.907 . . . . 25.0 108.333 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.04 148.09 45.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.437 1.118 . . . . 25.0 112.546 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -67.27 156.87 35.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.336 -1.357 . . . . 25.0 107.336 171.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.32 -3.49 1.91 Allowed Glycine 0 C--O 1.224 -0.522 0 CA-C-N 114.816 -1.084 . . . . 25.0 112.309 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -75.93 144.06 75.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 O-C-N 121.826 -0.809 . . . . 25.0 108.861 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -91.48 -17.32 15.96 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 N-CA-C 115.581 1.339 . . . . 25.0 115.581 -5.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -70.67 -35.34 72.79 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.73 1.381 . . . . 25.0 114.73 -169.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -119.01 35.14 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.547 -2.02 . . . . 25.0 105.547 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.12 177.21 47.57 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.617 -1.174 . . . . 25.0 111.691 -177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -61.94 172.2 4.15 Favored 'Trans proline' 0 C--O 1.241 0.635 0 C-N-CA 123.924 3.082 . . . . 25.0 113.821 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.96 159.86 31.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.789 -1.56 . . . . 25.0 106.789 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.17 138.68 57.86 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.258 -1.337 . . . . 25.0 107.438 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.08 -4.7 82.48 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.258 -0.496 . . . . 25.0 113.063 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.406 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 35.2 m170 -124.27 9.27 8.55 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.253 -0.647 . . . . 25.0 109.253 178.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.3 mt -64.87 -49.49 79.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.703 -0.226 . . . . 25.0 111.259 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.58 -29.3 63.4 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 p -77.54 -8.29 57.58 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.596 0.962 . . . . 25.0 113.596 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.52 34.26 18.02 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.641 0.776 . . . . 25.0 109.816 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.29 38.51 26.02 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.956 1.465 . . . . 25.0 114.956 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -119.67 134.73 55.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.106 0.562 . . . . 25.0 111.108 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 p -62.29 -34.7 77.09 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.915 1.82 . . . . 25.0 115.915 -173.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' H ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -70.42 -7.66 44.86 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.251 0.548 . . . . 25.0 112.437 -177.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.695 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.8 m-85 -122.51 14.23 10.25 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 107.521 -1.289 . . . . 25.0 107.521 -178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.49 -38.17 71.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.227 -0.921 . . . . 25.0 110.405 -176.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -71.5 -17.34 62.35 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 122.032 0.92 . . . . 25.0 109.345 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.695 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.2 mp -83.61 -5.94 59.31 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.553 -0.906 . . . . 25.0 108.553 -178.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -111.82 -32.06 6.74 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -96.58 116.45 29.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 O-C-N 121.471 -0.768 . . . . 25.0 111.127 -177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.459 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -122.64 160.55 25.55 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.881 -0.6 . . . . 25.0 109.466 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 6.1 p -116.93 162.57 26.78 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 100.541 -3.874 . . . . 25.0 100.541 162.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.55 -5.38 15.1 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 116.852 -1.632 . . . . 25.0 115.763 -175.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.2 t -125.67 12.38 7.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.291 0.567 . . . . 25.0 111.419 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -77.67 -29.44 51.55 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.817 0.673 . . . . 25.0 112.817 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.459 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.0 m95 -126.8 168.07 14.93 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 120.674 0.273 . . . . 25.0 110.505 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.0 t-20 -66.77 131.02 45.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 105.436 -2.061 . . . . 25.0 105.436 168.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -104.94 108.09 19.41 Favored 'General case' 0 CA--C 1.496 -1.117 0 N-CA-C 100.587 -3.857 . . . . 25.0 100.587 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.0 135.83 54.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 114.891 -1.05 . . . . 25.0 110.178 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -92.56 100.22 12.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.626 -1.17 . . . . 25.0 107.91 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.78 173.88 10.71 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 106.132 -1.803 . . . . 25.0 106.132 -176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -116.09 166.18 12.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.629 0.974 . . . . 25.0 113.629 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.408 HG21 ' HA ' ' A' ' 139' ' ' ALA . 72.3 p -77.04 169.14 18.87 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 106.638 -1.615 . . . . 25.0 106.638 174.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 90.96 -162.25 28.6 Favored Glycine 0 C--O 1.241 0.544 0 N-CA-C 111.078 -0.809 . . . . 25.0 111.078 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -59.08 133.32 52.46 Favored 'Trans proline' 0 C--N 1.346 0.422 0 CA-C-N 118.889 1.345 . . . . 25.0 114.212 -177.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -138.38 161.62 36.5 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.438 -1.69 . . . . 25.0 106.438 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -104.63 152.29 22.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.216 -1.401 . . . . 25.0 107.216 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -140.77 100.95 3.96 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.06 -1.83 . . . . 25.0 106.06 -176.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.46 113.8 27.58 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.83 0.824 . . . . 25.0 109.657 -178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.9 m95 -105.34 152.96 22.28 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.432 -0.804 . . . . 25.0 110.765 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -128.14 114.16 16.65 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.2 mp -115.85 104.92 12.11 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.297 -0.865 . . . . 25.0 112.812 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.9 t -70.91 -22.82 62.2 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.832 -0.803 . . . . 25.0 108.832 171.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.1 98.96 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 175.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -70.04 -18.9 63.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.297 1.221 . . . . 25.0 114.297 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -78.84 167.11 21.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.671 0.619 . . . . 25.0 112.671 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.6 t -64.54 155.54 32.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 117.254 2.316 . . . . 25.0 117.254 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 t -103.52 158.83 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 106.871 -1.529 . . . . 25.0 106.871 172.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.97 -12.76 10.07 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.398 0.518 . . . . 25.0 112.398 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.2 t -171.4 151.93 3.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.019 0.438 . . . . 25.0 112.171 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.5 m95 -127.23 139.76 52.69 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.105 -2.554 . . . . 25.0 104.105 167.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -145.82 144.59 30.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.37 -1.344 . . . . 25.0 107.37 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -133.86 134.47 42.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.624 -1.621 . . . . 25.0 106.624 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -149.29 163.13 38.56 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.556 -0.535 . . . . 25.0 109.556 178.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.85 165.12 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 113.685 0.994 . . . . 25.0 113.685 -168.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 16.6 p -79.11 161.69 26.33 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 169.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -61.14 159.04 31.54 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 25.0 109.205 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.72 -25.24 34.01 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 116.096 -2.136 . . . . 25.0 113.314 -175.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -114.43 32.06 6.2 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.034 0.534 . . . . 25.0 110.632 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.9 p-90 -73.24 167.41 21.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 122.029 0.918 . . . . 25.0 113.032 -176.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -83.16 101.08 10.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.447 -1.251 . . . . 25.0 109.59 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -93.48 8.56 40.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 115.989 1.848 . . . . 25.0 115.989 -169.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 14.1 t -118.03 9.76 12.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.401 -0.963 . . . . 25.0 108.401 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -115.11 157.76 42.72 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.115 -1.402 . . . . 25.0 107.599 -174.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -65.67 157.46 58.55 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 O-C-N 121.982 0.464 . . . . 25.0 111.226 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.93 100.95 2.05 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.227 0.537 . . . . 25.0 111.722 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.1 p -89.31 156.99 18.37 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.305 -1.368 . . . . 25.0 107.305 174.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.66 -24.93 66.35 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.44 0.638 . . . . 25.0 110.762 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.7 -25.96 64.13 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.996 -1.002 . . . . 25.0 112.914 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.3 m -80.6 -8.34 59.57 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 25.0 112.396 -177.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 41.9 m-85 -98.13 154.28 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 115.158 1.54 . . . . 25.0 115.158 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -97.02 96.44 8.48 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 102.614 -3.106 . . . . 25.0 102.614 162.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.92 -7.28 20.94 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -169.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -80.65 132.28 58.56 Favored Pre-proline 0 C--N 1.323 -0.58 0 N-CA-C 109.122 -0.696 . . . . 25.0 109.122 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -73.74 152.3 47.33 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 115.069 -2.821 . . . . 25.0 111.082 177.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -107.46 -11.41 15.51 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.988 0.423 . . . . 25.0 111.49 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 58.3 m -149.32 67.91 1.03 Allowed 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.317 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.58 138.99 30.99 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.126 -1.03 . . . . 25.0 108.738 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.79 101.04 5.71 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 104.715 -2.328 . . . . 25.0 104.715 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -94.56 92.19 6.95 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.5 -0.926 . . . . 25.0 108.5 -177.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -108.55 122.08 46.31 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 107.067 -1.457 . . . . 25.0 107.067 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.39 37.74 3.4 Favored Glycine 0 C--O 1.224 -0.489 0 N-CA-C 117.129 1.612 . . . . 25.0 117.129 -168.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 162.38 23.92 0.02 OUTLIER Glycine 0 C--N 1.319 -0.389 0 C-N-CA 120.354 -0.927 . . . . 25.0 113.452 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.62 104.16 9.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.381 0.61 . . . . 25.0 110.323 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 91.4 mt -75.47 123.57 88.62 Favored Pre-proline 0 C--N 1.321 -0.644 0 N-CA-C 104.894 -2.262 . . . . 25.0 104.894 173.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.75 165.34 33.01 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 117.725 -1.05 . . . . 25.0 113.577 -175.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.415 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -94.8 26.33 3.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 175.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.64 -8.43 0.92 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.987 1.715 . . . . 25.0 111.228 -173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.9 mt-30 -135.04 153.65 51.98 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.064 -2.569 . . . . 25.0 104.064 171.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.72 95.28 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.71 141.94 29.37 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 104.058 -2.571 . . . . 25.0 104.058 173.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.32 167.03 31.33 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.549 -1.659 . . . . 25.0 109.323 -176.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -134.54 157.38 46.69 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.655 -1.609 . . . . 25.0 106.655 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.46 160.89 26.8 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.545 -1.28 . . . . 25.0 107.545 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -108.22 114.98 29.28 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 123.333 0.396 . . . . 25.0 111.316 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.3 mt -78.58 132.76 64.36 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.68 -0.859 . . . . 25.0 108.68 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -62.35 147.44 94.94 Favored 'Trans proline' 0 C--N 1.354 0.841 0 CA-C-N 118.741 0.586 . . . . 25.0 113.611 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.408 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.55 -26.25 35.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 25.0 112.895 -169.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.0 p-10 -84.0 9.02 13.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 25.0 110.055 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -116.54 53.43 0.88 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 172.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.5 p -86.91 168.35 13.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 106.525 -1.657 . . . . 25.0 106.525 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 89.67 -167.55 33.76 Favored Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 115.535 0.974 . . . . 25.0 115.535 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.2 t -85.84 107.99 17.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.315 0.579 . . . . 25.0 110.707 -169.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -157.12 171.45 20.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.875 -0.602 . . . . 25.0 110.866 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.24 151.25 9.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 N-CA-C 107.816 -1.179 . . . . 25.0 107.816 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.8 mt -131.88 120.64 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 104.758 -2.312 . . . . 25.0 104.758 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.95 130.38 50.0 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.744 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.27 122.27 42.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.487 -0.931 . . . . 25.0 108.487 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.33 140.24 36.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 122.077 0.942 . . . . 25.0 110.197 -178.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -124.25 122.21 37.15 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 105.861 -1.903 . . . . 25.0 105.861 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.25 129.43 50.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 123.238 0.615 . . . . 25.0 109.963 -175.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 43.7 mm -78.06 140.93 16.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.681 -0.489 . . . . 25.0 109.681 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.41 -44.27 25.29 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.773 0.715 . . . . 25.0 111.027 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.26 -23.03 64.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 114.659 1.355 . . . . 25.0 114.659 -172.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.6 p -139.29 170.88 15.13 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.921 0.867 . . . . 25.0 109.707 -173.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.82 23.06 0.56 Allowed 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.17 -0.923 . . . . 25.0 112.365 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -94.2 143.75 26.11 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.593 -0.692 . . . . 25.0 112.822 -176.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.28 145.58 16.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 104.647 -2.353 . . . . 25.0 104.647 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -147.52 140.01 24.63 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.083 0.771 . . . . 25.0 113.083 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -94.63 112.3 24.05 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.63 0.772 . . . . 25.0 111.496 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -97.06 108.21 20.9 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.38 141.08 29.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.311 -0.859 . . . . 25.0 111.83 -176.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . 0.404 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.4 tt -125.58 134.59 66.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 106.187 -1.783 . . . . 25.0 106.187 167.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.34 130.67 39.02 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.317 -1.364 . . . . 25.0 107.317 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.3 m -131.54 161.19 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 112.81 0.67 . . . . 25.0 112.81 -175.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -118.67 95.1 4.71 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 104.059 -2.571 . . . . 25.0 104.059 168.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.4 tp -93.14 160.42 14.85 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 113.172 0.804 . . . . 25.0 113.172 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 65.6 p -145.97 167.17 23.98 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.77 -0.826 . . . . 25.0 108.77 174.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.869 -0.586 . . . . 25.0 109.94 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.8 m80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.248 -0.278 . . . . 25.0 110.248 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 127.01 170.59 12.9 Favored Glycine 0 C--N 1.322 -0.201 0 N-CA-C 103.507 -3.837 . . . . 25.0 103.507 -172.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -148.85 169.92 19.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 119.594 1.697 . . . . 25.0 111.385 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 126.11 62.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.031 -1.47 . . . . 25.0 107.031 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.64 -43.01 49.91 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.388 -0.824 . . . . 25.0 109.408 -175.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -153.56 133.57 7.62 Favored Pre-proline 0 C--N 1.321 -0.66 0 N-CA-C 105.503 -2.036 . . . . 25.0 105.503 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -65.25 135.46 23.53 Favored 'Cis proline' 0 CA--C 1.533 0.469 0 C-N-CA 128.754 0.731 . . . . 25.0 111.999 0.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.17 107.36 1.92 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.773 -0.649 . . . . 25.0 112.431 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 t -71.85 156.69 39.01 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.634 -0.506 . . . . 25.0 109.634 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 -55.4 -25.93 38.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.815 0.846 . . . . 25.0 112.444 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.25 -53.36 45.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.798 0.809 . . . . 25.0 109.134 175.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -66.37 -33.92 76.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.506 -0.77 . . . . 25.0 110.84 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -64.17 -33.2 75.24 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.948 -0.47 . . . . 25.0 110.244 177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -37.52 84.83 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 178.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -62.66 -39.22 93.24 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.257 0.551 . . . . 25.0 109.857 175.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.2 mt -77.45 5.12 9.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.025 -0.534 . . . . 25.0 112.117 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 58.62 22.13 9.48 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.115 1.366 . . . . 25.0 112.814 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.478 ' C ' HD22 ' A' ' 19' ' ' ASN . 95.1 mt -85.2 -20.16 30.59 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 107.895 -1.15 . . . . 25.0 107.895 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.478 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -121.81 156.72 32.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.314 -1.735 . . . . 25.0 106.314 177.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 p -134.58 175.98 9.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.366 -0.605 . . . . 25.0 109.366 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 68.08 5.01 4.36 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 175.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.2 m -67.25 -33.15 74.73 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 121.451 -0.781 . . . . 25.0 111.777 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.66 -62.61 1.55 Allowed Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.733 0.645 . . . . 25.0 112.376 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 t -91.75 -50.81 5.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 114.945 1.461 . . . . 25.0 114.945 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.98 -14.28 13.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.122 -1.399 . . . . 25.0 114.12 -165.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -79.45 -7.6 58.53 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.574 -0.85 . . . . 25.0 112.382 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -104.14 -38.92 6.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 119.229 -0.988 . . . . 25.0 111.048 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -131.21 95.98 23.2 Favored Pre-proline 0 C--O 1.241 0.641 0 N-CA-C 111.785 0.291 . . . . 25.0 111.785 168.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -71.26 -19.06 29.73 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 116.91 -1.593 . . . . 25.0 115.383 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -81.42 5.57 17.2 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 121.575 -0.703 . . . . 25.0 112.178 -178.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.4 m -66.45 -12.35 56.78 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.77 0.656 . . . . 25.0 112.77 177.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.05 132.88 29.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.881 0.848 . . . . 25.0 112.782 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -152.98 150.42 29.21 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.618 -1.623 . . . . 25.0 106.618 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -154.64 -168.38 17.92 Favored Glycine 0 CA--C 1.51 -0.261 0 N-CA-C 109.504 -1.439 . . . . 25.0 109.504 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -127.92 146.64 50.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.764 0.782 . . . . 25.0 111.174 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.98 157.01 29.42 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.176 -1.046 . . . . 25.0 108.176 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.27 -4.0 1.99 Allowed Glycine 0 C--N 1.318 -0.451 0 CA-C-N 114.726 -1.124 . . . . 25.0 112.847 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -75.96 148.09 81.29 Favored Pre-proline 0 C--N 1.321 -0.632 0 O-C-N 121.623 -0.928 . . . . 25.0 109.075 -177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -90.8 -18.64 14.53 Favored 'Cis proline' 0 CA--C 1.541 0.875 0 N-CA-C 115.95 1.481 . . . . 25.0 115.95 -4.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -77.77 -35.8 51.28 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.924 1.453 . . . . 25.0 114.924 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.02 33.27 5.33 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.364 -1.717 . . . . 25.0 106.364 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.07 -174.86 45.26 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.626 -1.17 . . . . 25.0 111.415 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -60.44 171.5 3.3 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 123.793 2.995 . . . . 25.0 113.322 177.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.14 159.98 30.99 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.23 137.38 58.0 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 106.652 -1.61 . . . . 25.0 106.652 176.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.21 -6.04 82.7 Favored Glycine 0 CA--C 1.509 -0.298 0 CA-C-O 121.416 0.453 . . . . 25.0 113.413 -174.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 51.0 m170 -125.02 10.04 8.15 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.404 -0.468 . . . . 25.0 110.218 179.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.8 mt -64.23 -48.77 84.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.443 -0.16 . . . . 25.0 111.232 -173.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.81 -24.34 55.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.072 0.463 . . . . 25.0 110.004 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 29.3 p -81.62 -8.61 59.73 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.031 0.752 . . . . 25.0 113.031 -176.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.89 34.79 17.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.714 0.805 . . . . 25.0 110.075 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.416 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.5 OUTLIER 58.44 41.11 23.33 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -177.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -121.34 135.01 55.15 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.287 0.635 . . . . 25.0 110.781 174.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -63.56 -34.44 77.81 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 115.497 1.665 . . . . 25.0 115.497 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 t -71.42 -8.05 51.32 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.347 0.594 . . . . 25.0 112.346 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.705 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.3 m-85 -119.1 15.02 13.22 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 107.447 -1.316 . . . . 25.0 107.447 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -71.81 -37.89 70.31 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.1 -1.0 . . . . 25.0 110.401 -177.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.4 mp0 -70.2 -16.31 63.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.879 0.847 . . . . 25.0 110.042 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.705 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.4 mp -86.16 -5.72 59.14 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.395 -0.965 . . . . 25.0 108.395 -178.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -112.49 -32.31 6.52 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.104 0.409 . . . . 25.0 112.104 173.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -96.07 121.89 38.32 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 121.628 -0.67 . . . . 25.0 110.185 -178.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.453 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -128.03 160.87 30.6 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.504 -0.771 . . . . 25.0 109.731 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.3 p -114.39 161.19 29.75 Favored Pre-proline 0 C--N 1.319 -0.74 1 N-CA-C 100.11 -4.033 . . . . 25.0 100.11 161.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.72 -2.16 9.67 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 116.961 -1.56 . . . . 25.0 115.765 -174.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -127.34 11.73 6.94 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.231 0.539 . . . . 25.0 111.65 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -78.93 -31.05 45.05 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.028 0.751 . . . . 25.0 113.028 -176.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 12.9 m95 -122.58 167.17 13.73 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 110.047 -0.353 . . . . 25.0 110.047 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -68.19 125.0 24.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.009 -1.848 . . . . 25.0 106.009 172.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -100.44 106.11 17.65 Favored 'General case' 0 CA--C 1.5 -0.981 0 N-CA-C 100.511 -3.885 . . . . 25.0 100.511 177.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.32 135.75 52.36 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.97 -1.014 . . . . 25.0 110.81 -176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -88.89 100.84 13.49 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 107.912 -1.144 . . . . 25.0 107.912 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.77 174.05 10.33 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.883 -1.895 . . . . 25.0 105.883 -177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -115.42 166.51 11.8 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.687 0.995 . . . . 25.0 113.687 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 72.5 p -77.12 171.61 14.55 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 106.297 -1.742 . . . . 25.0 106.297 173.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.99 -161.35 33.05 Favored Glycine 0 C--O 1.24 0.517 0 C-N-CA 120.436 -0.888 . . . . 25.0 111.198 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.09 132.95 50.06 Favored 'Trans proline' 0 C--N 1.345 0.394 0 CA-C-N 119.013 1.406 . . . . 25.0 114.392 -176.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -139.41 158.74 43.62 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.7 p -100.2 150.18 22.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -139.11 100.93 4.15 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 105.527 -2.027 . . . . 25.0 105.527 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.54 111.07 23.15 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.008 0.909 . . . . 25.0 111.004 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -97.8 147.42 24.41 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.305 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -124.01 110.55 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.602 -2.37 . . . . 25.0 104.602 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.44 130.91 45.74 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.166 -0.925 . . . . 25.0 109.478 -171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.7 t -72.73 -10.92 60.36 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.672 0.619 . . . . 25.0 112.672 -179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.98 147.6 27.35 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.805 -0.813 . . . . 25.0 108.805 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.9 mtm180 -81.22 13.68 2.74 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.287 0.847 . . . . 25.0 113.287 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.98 152.36 32.49 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.956 -0.757 . . . . 25.0 108.956 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.1 t -69.47 155.95 39.64 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.723 1.009 . . . . 25.0 113.723 -170.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.477 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 3.1 t -102.19 156.55 17.49 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.276 -1.379 . . . . 25.0 107.276 174.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.4 t -117.84 -15.94 10.0 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.168 0.293 . . . . 25.0 110.771 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.0 t -172.54 152.08 2.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.891 0.377 . . . . 25.0 111.975 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -123.67 140.71 52.72 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 103.687 -2.709 . . . . 25.0 103.687 166.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.3 mtt-85 -145.82 150.97 37.15 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.089 0.859 . . . . 25.0 108.978 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -137.98 137.49 37.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.084 -1.821 . . . . 25.0 106.084 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -147.88 160.09 43.15 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.62 -0.511 . . . . 25.0 109.62 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.24 164.5 34.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.217 0.821 . . . . 25.0 113.217 -168.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 p -79.76 162.51 25.1 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.434 -0.95 . . . . 25.0 108.434 171.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -64.06 161.87 35.81 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 115.249 -0.887 . . . . 25.0 109.472 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.59 -18.73 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 116.505 -1.863 . . . . 25.0 113.812 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.83 32.01 6.16 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.129 0.571 . . . . 25.0 111.034 -177.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.475 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 10.4 p-90 -68.94 172.68 6.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.293 1.22 . . . . 25.0 114.293 -176.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -83.11 98.41 9.31 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.0 -1.0 . . . . 25.0 109.099 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.475 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -96.27 5.3 51.28 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.913 1.82 . . . . 25.0 115.913 -168.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.6 t -128.42 17.22 6.5 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.295 -1.002 . . . . 25.0 108.295 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -122.53 161.0 45.99 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 114.195 -1.366 . . . . 25.0 107.503 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -62.96 151.92 82.05 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 118.443 -0.571 . . . . 25.0 111.133 173.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.5 108.81 3.44 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.554 0.575 . . . . 25.0 112.554 -175.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.7 p -95.66 153.31 17.79 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.126 -1.065 . . . . 25.0 108.126 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -68.13 -22.59 64.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.422 0.63 . . . . 25.0 110.111 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.81 -29.65 68.87 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.943 -1.026 . . . . 25.0 112.28 177.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.76 -3.04 59.0 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.045 0.387 . . . . 25.0 112.045 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -100.01 152.27 20.39 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 114.021 1.119 . . . . 25.0 114.021 -177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -97.02 92.85 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.632 -2.729 . . . . 25.0 103.632 165.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 72.0 mt -66.66 -6.49 15.72 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.564 1.32 . . . . 25.0 114.564 -170.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.43 122.02 78.69 Favored Pre-proline 0 C--N 1.323 -0.543 0 N-CA-C 108.856 -0.794 . . . . 25.0 108.856 176.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.85 135.6 28.22 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 115.26 -2.693 . . . . 25.0 111.945 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -87.0 -13.62 43.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.14 0.422 . . . . 25.0 112.14 -175.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.2 m -146.55 63.32 1.21 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.508 -0.314 . . . . 25.0 111.828 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -89.07 134.92 33.82 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 118.152 -1.419 . . . . 25.0 108.874 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -122.58 98.99 6.17 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 104.239 -2.504 . . . . 25.0 104.239 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -90.32 92.05 8.75 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.045 -1.095 . . . . 25.0 108.045 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -106.31 122.06 45.49 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.75 84.11 0.39 Allowed Glycine 0 CA--C 1.504 -0.602 0 CA-C-N 115.123 -0.944 . . . . 25.0 112.811 -171.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.56 15.63 13.31 Favored Glycine 0 C--N 1.32 -0.337 0 C-N-CA 120.901 -0.666 . . . . 25.0 113.464 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.13 106.73 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.366 -0.976 . . . . 25.0 108.366 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 79.2 mt -72.48 117.58 60.2 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 107.583 -1.266 . . . . 25.0 107.583 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -76.94 166.89 26.11 Favored 'Trans proline' 0 C--N 1.345 0.35 0 N-CA-C 114.682 0.993 . . . . 25.0 114.682 -176.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.44 26.39 4.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.763 -0.829 . . . . 25.0 108.763 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.72 -16.89 0.37 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.688 1.595 . . . . 25.0 112.33 -175.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -129.31 146.96 51.11 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 103.988 -2.597 . . . . 25.0 103.988 172.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.8 t -138.71 95.03 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 106.226 -1.768 . . . . 25.0 106.226 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -89.26 132.66 34.79 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 104.662 -2.348 . . . . 25.0 104.662 173.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -145.2 166.98 23.88 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -175.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -132.11 156.39 46.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.85 159.87 33.03 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -104.67 119.03 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.08 0.238 . . . . 25.0 111.191 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 59.1 mt -79.27 132.81 61.7 Favored Pre-proline 0 C--O 1.24 0.6 0 N-CA-C 108.276 -1.009 . . . . 25.0 108.276 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -60.64 147.41 94.83 Favored 'Trans proline' 0 C--N 1.354 0.844 0 N-CA-C 113.84 0.669 . . . . 25.0 113.84 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -81.41 -26.46 35.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.159 -0.928 . . . . 25.0 112.717 -169.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.2 p-10 -83.63 10.35 9.4 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.744 0.783 . . . . 25.0 110.208 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -115.97 51.4 0.96 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.43 -0.952 . . . . 25.0 108.43 172.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.4 p -86.24 162.22 18.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.582 -1.636 . . . . 25.0 106.582 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.6 -165.68 29.9 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 114.839 0.696 . . . . 25.0 114.839 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 37.4 t -85.85 110.85 19.68 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.491 0.662 . . . . 25.0 110.954 -168.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -157.39 170.98 21.22 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-N 115.72 -0.673 . . . . 25.0 110.493 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.63 151.54 11.88 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 N-CA-C 107.725 -1.213 . . . . 25.0 107.725 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 58.8 mt -131.55 121.27 47.7 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 104.809 -2.293 . . . . 25.0 104.809 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -103.05 128.76 49.8 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.663 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.43 131.59 56.27 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 123.005 0.522 . . . . 25.0 109.804 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.42 145.76 34.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 122.125 0.965 . . . . 25.0 112.249 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.477 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 12.7 t90 -116.77 119.37 35.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.161 -1.792 . . . . 25.0 106.161 173.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.81 121.41 38.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 7.4 mm -77.28 143.51 12.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.156 -1.053 . . . . 25.0 108.156 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.54 -41.02 28.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 118.847 0.749 . . . . 25.0 109.637 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.16 -22.69 64.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.011 1.115 . . . . 25.0 114.011 -172.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -138.5 169.14 18.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.993 0.902 . . . . 25.0 110.236 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -82.01 17.96 1.45 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.162 -0.926 . . . . 25.0 111.969 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -90.03 144.65 25.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.915 0.709 . . . . 25.0 112.915 -175.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.49 141.34 14.62 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.089 -2.189 . . . . 25.0 105.089 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -146.51 131.85 18.55 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 117.766 0.257 . . . . 25.0 111.432 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -89.95 117.32 28.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.955 -0.566 . . . . 25.0 110.916 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -96.96 107.99 20.62 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.1 140.79 32.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.641 -0.709 . . . . 25.0 111.999 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 134.4 66.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 106.404 -1.702 . . . . 25.0 106.404 168.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -92.47 132.21 36.98 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.886 -1.153 . . . . 25.0 107.886 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -133.54 161.74 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -176.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -120.64 95.0 4.54 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.637 -2.357 . . . . 25.0 104.637 169.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.58 160.1 16.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 113.277 0.843 . . . . 25.0 113.277 -170.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 70.4 p -145.8 166.58 25.51 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.821 -0.437 . . . . 25.0 109.821 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.709 -0.662 . . . . 25.0 110.333 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 47.0 m170 . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.963 0.411 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.66 30.97 Favored Glycine 0 N--CA 1.45 -0.377 1 N-CA-C 102.709 -4.156 . . . . 25.0 102.709 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -147.32 168.52 21.57 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 119.523 1.662 . . . . 25.0 109.276 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -105.28 122.83 59.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 108.147 -1.057 . . . . 25.0 108.147 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -72.22 -42.69 65.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.845 -1.071 . . . . 25.0 109.697 -175.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.2 t -153.02 129.24 5.32 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 105.975 -1.861 . . . . 25.0 105.975 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -64.67 134.46 19.29 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 128.798 0.749 . . . . 25.0 111.585 -0.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 113.17 4.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.626 0.602 . . . . 25.0 112.626 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -72.11 155.03 40.73 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.104 -0.702 . . . . 25.0 109.104 -178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -56.74 -26.38 57.03 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.286 0.635 . . . . 25.0 112.163 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -48.41 63.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.975 -0.75 . . . . 25.0 108.975 176.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -66.38 -36.65 83.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.624 -0.716 . . . . 25.0 109.638 178.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.84 -33.43 75.66 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 122.228 -0.295 . . . . 25.0 110.587 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -39.64 93.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 25.0 109.96 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -66.63 -35.37 80.01 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.211 0.529 . . . . 25.0 110.071 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.4 mt -79.4 6.42 10.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.485 . . . . 25.0 111.731 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 59.09 21.45 9.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.056 1.343 . . . . 25.0 113.314 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.47 ' C ' HD22 ' A' ' 19' ' ' ASN . 92.5 mt -87.75 -20.62 25.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.996 -1.113 . . . . 25.0 107.996 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.47 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.0 m120 -123.33 158.95 29.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.075 -2.194 . . . . 25.0 105.075 176.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.1 p -135.38 174.68 10.34 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 122.307 0.243 . . . . 25.0 110.447 -175.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 69.71 5.08 5.03 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.978 1.844 . . . . 25.0 115.978 174.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.1 m -66.8 -39.25 87.69 Favored 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 121.483 -0.761 . . . . 25.0 110.491 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.87 -64.19 1.55 Allowed Glycine 0 C--O 1.217 -0.965 0 O-C-N 123.593 0.558 . . . . 25.0 112.303 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 t -88.01 -53.69 4.6 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.655 1.217 . . . . 25.0 111.592 -178.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.2 OUTLIER -69.95 -6.9 7.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.32 -1.309 . . . . 25.0 113.377 -171.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -88.34 2.59 52.21 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.08 -0.387 . . . . 25.0 111.508 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -116.78 -37.93 3.54 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.4 -0.92 . . . . 25.0 111.383 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -127.51 93.68 39.99 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 122.047 0.139 . . . . 25.0 111.35 167.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.463 ' HA ' HG12 ' A' ' 25' ' ' VAL . 83.5 Cg_endo -70.19 -19.33 34.23 Favored 'Trans proline' 0 C--N 1.343 0.28 0 N-CA-C 115.614 1.351 . . . . 25.0 115.614 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -82.44 4.95 22.16 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.703 -0.623 . . . . 25.0 112.398 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.1 m -68.55 -9.61 50.48 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 m -64.04 136.65 26.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 122.176 0.988 . . . . 25.0 112.916 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -153.02 160.26 42.97 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 103.742 -2.688 . . . . 25.0 103.742 177.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.84 -170.97 27.31 Favored Glycine 0 C--O 1.226 -0.389 0 N-CA-C 108.439 -1.865 . . . . 25.0 108.439 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.74 145.35 49.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 118.811 1.306 . . . . 25.0 112.142 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -66.57 156.98 33.51 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.415 -1.328 . . . . 25.0 107.415 172.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.24 1.66 2.81 Favored Glycine 0 C--O 1.224 -0.528 0 CA-C-N 114.921 -1.036 . . . . 25.0 113.114 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -76.06 140.86 70.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 121.633 -0.922 . . . . 25.0 108.848 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -92.66 -15.41 17.52 Favored 'Cis proline' 0 CA--C 1.544 0.993 0 N-CA-C 115.603 1.347 . . . . 25.0 115.603 -5.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.87 -36.3 72.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.878 1.436 . . . . 25.0 114.878 -169.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.15 30.21 7.11 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 105.612 -1.996 . . . . 25.0 105.612 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.57 -177.2 40.0 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 114.376 -1.284 . . . . 25.0 110.835 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -62.3 170.75 6.12 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.706 2.27 . . . . 25.0 113.445 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 159.95 31.1 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.381 -1.34 . . . . 25.0 107.381 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -61.41 139.08 58.26 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 106.767 -1.568 . . . . 25.0 106.767 174.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.52 -6.1 83.09 Favored Glycine 0 C--O 1.228 -0.228 0 CA-C-N 116.047 -0.524 . . . . 25.0 112.439 -173.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -126.2 11.19 7.54 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.53 -0.394 . . . . 25.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.7 mt -63.28 -52.18 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 O-C-N 122.209 -0.307 . . . . 25.0 111.556 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.59 -21.52 57.74 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.75 -0.463 . . . . 25.0 109.75 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.6 p -81.94 -8.87 59.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.78 0.659 . . . . 25.0 112.78 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.1 32.01 12.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.519 0.728 . . . . 25.0 110.292 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.94 36.83 24.68 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.557 1.317 . . . . 25.0 114.557 -176.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 mmtm -119.82 133.31 55.64 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.927 0.491 . . . . 25.0 110.615 175.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.4 p -61.12 -33.08 72.81 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.126 1.158 . . . . 25.0 114.126 -175.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.8 t -66.24 -15.97 63.63 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.48 0.657 . . . . 25.0 112.076 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.698 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -117.25 14.31 14.78 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.744 -0.835 . . . . 25.0 108.744 -178.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -71.16 -38.76 72.17 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.895 -1.128 . . . . 25.0 111.325 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.3 mp0 -71.31 -13.66 61.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.803 0.811 . . . . 25.0 109.677 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.698 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -88.02 -4.65 58.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.693 -0.854 . . . . 25.0 108.693 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -113.11 -32.58 6.28 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.842 0.682 . . . . 25.0 112.842 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -97.09 123.08 40.75 Favored 'General case' 0 CA--C 1.507 -0.71 0 O-C-N 121.534 -0.729 . . . . 25.0 109.845 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.44 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -124.96 160.94 27.75 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.193 -0.912 . . . . 25.0 110.006 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.6 p -119.01 161.14 37.97 Favored Pre-proline 0 C--N 1.317 -0.815 1 N-CA-C 100.087 -4.042 . . . . 25.0 100.087 163.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.41 -5.31 15.68 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 116.924 -1.584 . . . . 25.0 115.64 -174.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.6 t -124.64 10.73 8.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.198 0.523 . . . . 25.0 111.7 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -78.17 -30.14 48.95 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.726 -0.609 . . . . 25.0 112.474 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.0 m95 -123.74 165.4 17.33 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.536 0.208 . . . . 25.0 110.646 -177.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 -68.12 128.51 36.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 105.79 -1.929 . . . . 25.0 105.79 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.5 mmtt -101.33 106.49 17.67 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 100.929 -3.73 . . . . 25.0 100.929 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.02 135.58 52.51 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.022 -0.99 . . . . 25.0 110.511 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -89.88 101.49 14.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.738 -1.119 . . . . 25.0 107.985 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -130.68 173.86 10.49 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.632 -1.247 . . . . 25.0 107.632 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -114.69 161.9 17.51 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.275 0.843 . . . . 25.0 113.275 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.445 HG21 ' HA ' ' A' ' 139' ' ' ALA . 71.3 p -78.15 172.49 13.47 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 106.593 -1.632 . . . . 25.0 106.593 171.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.37 -162.38 32.0 Favored Glycine 0 C--O 1.241 0.562 0 N-CA-C 110.825 -0.91 . . . . 25.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.62 129.91 34.67 Favored 'Trans proline' 0 C--N 1.345 0.382 0 CA-C-N 118.961 1.38 . . . . 25.0 114.514 -176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -138.71 160.11 40.44 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.18 -1.785 . . . . 25.0 106.18 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 54.6 p -106.44 152.34 23.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.464 -1.31 . . . . 25.0 107.464 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -135.82 100.93 4.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.475 -2.417 . . . . 25.0 104.475 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.89 106.99 18.02 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.304 -0.862 . . . . 25.0 110.446 -176.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -92.8 146.94 23.26 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.62 -0.718 . . . . 25.0 109.944 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -127.53 116.08 19.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 103.937 -2.616 . . . . 25.0 103.937 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -116.42 125.6 52.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.535 -0.757 . . . . 25.0 112.689 -173.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.4 t -87.62 5.33 40.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.314 0.578 . . . . 25.0 110.245 173.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.61 116.74 21.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.93 0.395 . . . . 25.0 110.366 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -79.84 2.88 21.47 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.91 1.078 . . . . 25.0 113.91 -178.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.92 153.18 42.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.698 -0.482 . . . . 25.0 109.698 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 156.01 39.72 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.533 0.938 . . . . 25.0 113.533 -172.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.0 t -99.64 158.91 15.43 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.215 -1.031 . . . . 25.0 108.215 174.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -117.91 -15.31 10.0 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.161 0.288 . . . . 25.0 111.25 171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.6 t -171.89 153.21 3.18 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.939 0.4 . . . . 25.0 111.951 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 52.1 m95 -125.72 139.66 53.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 104.404 -2.443 . . . . 25.0 104.404 167.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.7 mtt-85 -145.01 151.42 38.54 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.342 -0.984 . . . . 25.0 108.342 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -138.01 135.04 35.55 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.12 161.71 41.42 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 118.35 0.523 . . . . 25.0 109.973 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.34 162.59 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 113.757 1.021 . . . . 25.0 113.757 -167.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -76.74 161.23 28.66 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.648 -1.242 . . . . 25.0 107.648 171.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.93 157.52 40.16 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.147 -0.933 . . . . 25.0 110.202 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -67.75 -19.7 47.0 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 117.858 -0.961 . . . . 25.0 114.285 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -120.98 31.99 6.16 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 122.819 0.448 . . . . 25.0 111.64 -177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.72 163.99 27.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.942 0.877 . . . . 25.0 112.942 -176.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.33 101.02 11.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.433 -1.258 . . . . 25.0 110.348 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -86.5 17.35 3.89 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.828 2.158 . . . . 25.0 116.828 -169.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.8 t -125.4 6.72 7.68 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.689 0.757 . . . . 25.0 109.315 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -107.72 158.45 33.35 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.7 -1.137 . . . . 25.0 108.416 -173.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -66.53 156.12 66.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 O-C-N 121.961 0.453 . . . . 25.0 111.812 178.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -70.33 100.1 1.67 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.123 0.487 . . . . 25.0 112.033 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.6 p -93.51 152.72 18.87 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.648 -1.241 . . . . 25.0 107.648 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -66.14 -25.19 66.86 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.745 -0.597 . . . . 25.0 111.073 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.29 65.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.306 -0.861 . . . . 25.0 112.235 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.5 t -82.02 -5.51 58.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.319 0.489 . . . . 25.0 112.319 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -103.87 154.24 19.84 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 114.673 1.36 . . . . 25.0 114.673 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -94.87 95.65 8.81 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 103.013 -2.958 . . . . 25.0 103.013 163.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.97 -7.03 19.29 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.109 1.152 . . . . 25.0 114.109 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.68 118.75 73.39 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.89 -0.781 . . . . 25.0 108.89 176.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.36 141.31 42.49 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 115.403 -2.598 . . . . 25.0 111.804 179.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -89.98 -12.97 37.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.523 0.564 . . . . 25.0 112.523 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 66.6 m -149.11 66.11 1.03 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.488 -0.324 . . . . 25.0 111.259 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -88.99 132.52 34.69 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.749 -1.181 . . . . 25.0 109.018 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -123.03 99.19 6.25 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 104.664 -2.347 . . . . 25.0 104.664 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -90.27 92.06 8.76 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.418 -1.327 . . . . 25.0 107.418 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -104.48 118.17 35.94 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.979 -1.489 . . . . 25.0 106.979 177.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -101.84 80.53 0.4 Allowed Glycine 0 CA--C 1.503 -0.696 0 CA-C-N 115.396 -0.82 . . . . 25.0 113.48 -170.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.47 15.18 6.03 Favored Glycine 0 C--N 1.322 -0.25 0 C-N-CA 120.916 -0.659 . . . . 25.0 113.661 178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.48 104.82 5.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.563 0.697 . . . . 25.0 109.689 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.38 123.23 89.26 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 106.092 -1.818 . . . . 25.0 106.092 176.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.68 161.39 44.06 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 118.352 -0.632 . . . . 25.0 113.739 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.58 26.61 3.38 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.965 -1.124 . . . . 25.0 107.965 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.13 -15.45 0.41 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.975 1.71 . . . . 25.0 111.947 -174.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -129.43 151.01 50.53 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 103.776 -2.675 . . . . 25.0 103.776 169.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.46 95.0 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 122.382 1.087 . . . . 25.0 108.633 -178.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.8 m -87.36 124.72 33.69 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -118.4 162.44 18.32 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 105.27 -2.122 . . . . 25.0 105.27 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -133.95 146.35 50.4 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 103.81 -2.663 . . . . 25.0 103.81 171.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.22 158.81 27.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.986 -1.116 . . . . 25.0 107.986 -176.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -102.13 117.0 33.86 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.119 0.262 . . . . 25.0 110.67 -177.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.5 mt -75.31 132.13 76.72 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 107.238 -1.393 . . . . 25.0 107.238 177.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.89 145.93 96.7 Favored 'Trans proline' 0 C--N 1.352 0.742 0 CA-C-O 121.753 0.647 . . . . 25.0 113.492 -178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.445 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.11 -25.83 39.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.093 -0.958 . . . . 25.0 112.48 -168.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -84.01 9.12 13.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.697 -0.683 . . . . 25.0 110.165 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -116.0 51.26 0.97 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 121.837 0.827 . . . . 25.0 108.966 172.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.9 p -86.11 165.2 16.79 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 106.868 -1.53 . . . . 25.0 106.868 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.29 -169.09 32.83 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 114.541 0.576 . . . . 25.0 114.541 178.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.0 114.36 22.83 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.433 0.635 . . . . 25.0 111.116 -168.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -159.96 170.46 21.3 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.725 -0.671 . . . . 25.0 110.657 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 p -105.85 150.61 8.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 107.406 -1.331 . . . . 25.0 107.406 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 50.1 mt -131.45 120.21 45.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.214 -2.143 . . . . 25.0 105.214 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -102.78 130.07 49.64 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.453 -0.794 . . . . 25.0 109.545 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -116.66 129.74 56.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.533 -0.914 . . . . 25.0 108.533 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.72 140.18 48.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.154 0.978 . . . . 25.0 112.028 -177.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -114.53 117.36 30.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 106.43 -1.693 . . . . 25.0 106.43 177.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.08 126.49 42.28 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.36 -0.978 . . . . 25.0 108.36 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.5 mm -81.79 141.62 14.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.453 -0.573 . . . . 25.0 109.453 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.58 -42.39 22.37 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.767 0.712 . . . . 25.0 110.394 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.09 -24.08 65.0 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.583 0.957 . . . . 25.0 113.583 -172.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.7 p -139.32 170.54 15.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.966 0.889 . . . . 25.0 110.21 -174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.22 23.64 0.58 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.125 -0.943 . . . . 25.0 112.21 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -94.32 147.48 23.16 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.691 -0.631 . . . . 25.0 112.606 -176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.19 143.24 12.08 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.053 -2.203 . . . . 25.0 105.053 172.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -146.66 136.03 22.82 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.997 0.74 . . . . 25.0 112.997 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -93.98 114.8 27.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.524 -0.762 . . . . 25.0 111.54 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -97.05 113.37 24.91 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.21 140.71 29.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.043 -0.526 . . . . 25.0 112.051 -177.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.5 tt -125.13 135.47 63.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 105.787 -1.931 . . . . 25.0 105.787 167.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -95.31 131.2 41.67 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.766 -1.198 . . . . 25.0 107.766 176.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.5 m -132.76 163.23 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 113.103 0.779 . . . . 25.0 113.103 -175.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -119.53 95.04 4.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 104.386 -2.45 . . . . 25.0 104.386 167.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.3 tp -90.03 163.96 14.7 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 112.689 0.625 . . . . 25.0 112.689 -172.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.5 p -144.33 156.74 44.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.153 -1.054 . . . . 25.0 108.153 175.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.379 -0.82 . . . . 25.0 112.416 -175.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 29.7 m170 . . . . . 0 N--CA 1.484 1.237 0 CA-C-O 121.372 0.606 . . . . 25.0 110.761 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.26 168.76 34.14 Favored Glycine 0 N--CA 1.451 -0.32 1 N-CA-C 100.85 -4.9 . . . . 25.0 100.85 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -146.69 162.64 38.06 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 120.374 2.087 . . . . 25.0 110.507 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -99.34 122.6 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.979 -1.119 . . . . 25.0 107.979 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -73.42 -42.95 61.41 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.801 -1.09 . . . . 25.0 109.593 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -152.62 129.56 5.61 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 106.129 -1.804 . . . . 25.0 106.129 177.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.67 133.37 16.49 Favored 'Cis proline' 0 CA--C 1.534 0.495 0 C-N-CA 128.577 0.657 . . . . 25.0 111.476 -0.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.52 110.72 3.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 25.0 112.409 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 156.81 38.74 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.275 -0.639 . . . . 25.0 109.275 -178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -56.3 -24.77 45.54 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.642 0.777 . . . . 25.0 112.656 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.99 -49.89 58.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.771 0.796 . . . . 25.0 109.066 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -66.22 -37.43 85.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.468 -0.787 . . . . 25.0 109.888 177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -63.17 -33.1 74.73 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 122.258 -0.276 . . . . 25.0 110.808 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.55 -39.07 91.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.246 0.546 . . . . 25.0 110.235 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.447 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -67.67 -35.92 79.76 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.565 -0.531 . . . . 25.0 109.565 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.9 mt -77.37 4.09 11.65 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.21 -0.45 . . . . 25.0 111.599 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 58.19 22.44 9.15 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.306 1.443 . . . . 25.0 113.265 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.461 ' C ' HD22 ' A' ' 19' ' ' ASN . 93.1 mt -85.03 -21.09 29.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.242 -1.392 . . . . 25.0 107.242 173.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.461 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.04 158.16 32.81 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.2 p -136.77 175.34 9.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.112 -0.329 . . . . 25.0 110.112 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 72.11 4.91 5.17 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.423 1.638 . . . . 25.0 115.423 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -66.63 -38.26 86.55 Favored 'General case' 0 CA--C 1.501 -0.918 0 O-C-N 121.823 -0.548 . . . . 25.0 110.972 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.41 -63.49 1.42 Allowed Glycine 0 C--O 1.218 -0.854 0 O-C-N 123.753 0.658 . . . . 25.0 112.271 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.9 t -87.81 -54.35 4.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.571 1.177 . . . . 25.0 111.37 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.445 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -68.83 -7.01 6.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.236 -1.347 . . . . 25.0 113.82 -171.686 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.437 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.9 pt20 -91.51 0.3 57.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.848 -0.533 . . . . 25.0 111.261 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -116.02 -34.08 4.85 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.904 -0.719 . . . . 25.0 109.893 173.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -126.91 101.75 25.83 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 109.284 -0.636 . . . . 25.0 109.284 169.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.447 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 98.0 Cg_endo -73.24 -20.4 21.37 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 117.108 -1.461 . . . . 25.0 114.53 -174.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -86.17 11.87 10.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.338 0.495 . . . . 25.0 112.338 -178.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.1 m -65.18 -12.42 50.96 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.1 130.24 28.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 122.135 0.969 . . . . 25.0 112.919 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -152.96 151.07 29.89 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 104.975 -2.232 . . . . 25.0 104.975 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.65 -169.38 22.89 Favored Glycine 0 C--O 1.229 -0.216 0 N-CA-C 109.755 -1.338 . . . . 25.0 109.755 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.42 147.83 49.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 118.051 0.926 . . . . 25.0 111.725 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -65.99 157.04 31.87 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.883 -1.154 . . . . 25.0 107.883 172.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.58 -4.01 1.66 Allowed Glycine 0 C--N 1.317 -0.494 0 CA-C-N 114.773 -1.103 . . . . 25.0 112.91 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -75.76 144.58 76.9 Favored Pre-proline 0 C--N 1.321 -0.636 0 O-C-N 121.689 -0.889 . . . . 25.0 109.116 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -91.54 -17.86 14.83 Favored 'Cis proline' 0 CA--C 1.543 0.962 0 N-CA-C 116.041 1.516 . . . . 25.0 116.041 -5.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.6 -37.44 62.88 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.913 1.449 . . . . 25.0 114.913 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -116.47 32.29 6.22 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.212 -1.773 . . . . 25.0 106.212 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -88.59 -176.94 47.0 Favored Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 114.591 -1.186 . . . . 25.0 110.744 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.95 171.54 3.68 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.982 2.455 . . . . 25.0 113.095 177.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.11 160.07 30.9 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 107.726 -1.213 . . . . 25.0 107.726 174.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.75 139.62 57.14 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 106.038 -1.838 . . . . 25.0 106.038 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.417 ' HA2' ' HB2' ' A' ' 106' ' ' PRO . . . 86.4 -8.02 76.33 Favored Glycine 0 C--O 1.229 -0.163 0 CA-C-N 116.403 -0.362 . . . . 25.0 112.666 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -126.18 9.5 7.37 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.396 -0.473 . . . . 25.0 111.329 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.86 -49.53 83.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 O-C-N 122.151 -0.343 . . . . 25.0 111.166 -174.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.86 -20.9 57.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.98 0.419 . . . . 25.0 110.266 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -84.73 -8.57 58.79 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.995 0.739 . . . . 25.0 112.995 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 33.31 13.65 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.53 0.732 . . . . 25.0 110.043 -172.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.47 39.24 25.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.816 1.414 . . . . 25.0 114.816 -177.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm -120.55 137.55 54.33 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.105 0.562 . . . . 25.0 110.714 175.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.0 p -62.95 -36.28 82.95 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 115.617 1.71 . . . . 25.0 115.617 -173.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 t -72.29 -5.01 33.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 112.531 0.567 . . . . 25.0 112.531 -177.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.702 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.2 m-85 -121.14 12.5 11.08 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -72.23 -36.5 69.12 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.051 -1.031 . . . . 25.0 110.106 -176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -71.69 -11.07 60.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.496 -0.774 . . . . 25.0 109.715 175.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.0 mp -93.95 -1.3 54.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.822 -0.807 . . . . 25.0 108.822 -177.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -116.26 -32.02 5.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.567 0.58 . . . . 25.0 112.567 174.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -92.22 131.77 37.19 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 107.453 -1.314 . . . . 25.0 107.453 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.476 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.3 pm0 -137.56 160.61 38.69 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.405 -0.816 . . . . 25.0 111.443 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 52.8 p -119.99 159.57 46.42 Favored Pre-proline 0 C--O 1.242 0.667 1 N-CA-C 100.068 -4.049 . . . . 25.0 100.068 159.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -70.32 -6.37 18.72 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 116.281 -2.012 . . . . 25.0 115.558 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.2 t -114.5 2.1 14.51 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.636 0.606 . . . . 25.0 112.636 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -78.33 -28.13 47.26 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.088 0.773 . . . . 25.0 113.088 -175.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.476 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.5 m95 -124.5 163.13 22.5 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 120.581 0.229 . . . . 25.0 110.608 -177.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.31 129.49 40.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 106.158 -1.793 . . . . 25.0 106.158 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -101.86 107.56 18.78 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 100.231 -3.989 . . . . 25.0 100.231 177.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -68.37 134.48 50.32 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.242 -0.89 . . . . 25.0 110.141 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -92.63 100.78 13.23 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.743 -1.117 . . . . 25.0 108.0 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.5 mt -131.17 173.99 10.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.106 -1.072 . . . . 25.0 108.106 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.23 154.33 25.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 111.519 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.445 HG22 HD23 ' A' ' 168' ' ' LEU . 58.9 p -77.04 168.37 20.2 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.396 -1.335 . . . . 25.0 107.396 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 96.61 -161.86 22.2 Favored Glycine 0 C--O 1.241 0.564 0 N-CA-C 110.366 -1.094 . . . . 25.0 110.366 -178.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.95 132.29 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 CA-C-N 119.057 1.429 . . . . 25.0 113.482 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.94 160.76 38.47 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.473 -1.677 . . . . 25.0 106.473 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 p -101.37 151.1 22.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.686 -1.227 . . . . 25.0 107.686 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -138.02 100.97 4.3 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 105.074 -2.195 . . . . 25.0 105.074 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.07 114.33 28.15 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.356 -0.838 . . . . 25.0 110.038 -176.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -101.5 150.96 22.53 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.526 -0.761 . . . . 25.0 110.631 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.6 mmtt -126.63 116.46 21.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 104.092 -2.559 . . . . 25.0 104.092 177.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.76 126.64 55.64 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.547 -0.751 . . . . 25.0 110.952 -174.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.3 t -89.01 13.9 11.85 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.44 0.638 . . . . 25.0 110.565 176.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -133.68 138.75 46.03 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.94 -0.475 . . . . 25.0 109.855 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -86.09 -7.67 58.43 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.681 0.623 . . . . 25.0 112.681 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.77 157.92 31.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.856 0.687 . . . . 25.0 112.856 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.4 t -76.98 156.0 32.22 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 114.809 1.411 . . . . 25.0 114.809 -172.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -97.14 159.41 14.93 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 108.501 -0.926 . . . . 25.0 108.501 172.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -117.81 -14.54 10.11 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 123.127 0.267 . . . . 25.0 111.263 171.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -172.19 152.85 2.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.947 0.403 . . . . 25.0 111.335 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -125.43 136.91 53.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 104.912 -2.255 . . . . 25.0 104.912 167.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.5 mtm180 -142.04 150.19 40.94 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.044 -1.095 . . . . 25.0 108.044 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -136.57 133.6 36.56 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 105.475 -2.046 . . . . 25.0 105.475 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -149.03 164.14 35.48 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.334 0.515 . . . . 25.0 110.595 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.91 164.81 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.331 0.863 . . . . 25.0 113.331 -166.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.6 p -81.33 162.92 23.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.286 -1.375 . . . . 25.0 107.286 168.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -61.27 157.71 42.21 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.468 -0.787 . . . . 25.0 108.996 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -69.0 -22.33 35.75 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 116.464 -1.891 . . . . 25.0 114.021 -173.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -114.05 31.9 6.24 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.322 0.49 . . . . 25.0 112.322 -173.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.506 ' HE1' ' HA ' ' A' ' 145' ' ' HIS . 5.5 p-90 -80.42 163.31 23.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.527 0.68 . . . . 25.0 110.106 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -87.28 101.08 13.19 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.309 -0.86 . . . . 25.0 110.324 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -80.19 22.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 115.253 1.575 . . . . 25.0 115.253 -174.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.1 t -118.93 1.09 11.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.565 0.697 . . . . 25.0 109.852 175.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -112.51 160.0 32.02 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 107.937 -1.135 . . . . 25.0 107.937 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . 0.417 ' HB2' ' HA2' ' A' ' 46' ' ' GLY . 58.1 Cg_endo -64.36 159.48 43.67 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 120.431 0.754 . . . . 25.0 112.592 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.4 mp -68.12 117.12 9.54 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 122.189 -0.32 . . . . 25.0 110.293 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.5 p -114.41 150.59 34.45 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.578 -0.897 . . . . 25.0 108.578 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.8 ptp180 -64.57 -24.9 67.75 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.977 -0.452 . . . . 25.0 111.621 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.54 72.72 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.699 -0.682 . . . . 25.0 111.999 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 85.0 p -88.98 -3.01 58.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.111 -0.495 . . . . 25.0 111.978 -178.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -97.28 150.81 20.53 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.941 1.46 . . . . 25.0 114.941 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.23 96.15 8.22 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 102.883 -3.006 . . . . 25.0 102.883 162.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.26 0.63 7.52 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.142 1.164 . . . . 25.0 114.142 -171.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 10.2 t -98.19 134.46 22.01 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.197 -0.668 . . . . 25.0 109.197 178.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -73.93 146.81 37.99 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 116.447 -1.902 . . . . 25.0 112.29 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -97.1 -6.63 34.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.995 0.426 . . . . 25.0 111.335 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 36.0 m -151.71 71.61 0.99 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -88.88 131.35 35.15 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 119.172 -1.011 . . . . 25.0 109.628 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -122.03 99.06 6.23 Favored 'General case' 0 CA--C 1.503 -0.854 0 N-CA-C 103.465 -2.791 . . . . 25.0 103.465 176.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -92.8 91.95 7.71 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.433 -1.321 . . . . 25.0 107.433 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -113.74 118.56 34.66 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 108.205 -1.035 . . . . 25.0 108.205 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.81 81.8 0.36 Allowed Glycine 0 CA--C 1.501 -0.841 0 CA-C-N 115.551 -0.749 . . . . 25.0 112.901 -170.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.47 16.06 5.24 Favored Glycine 0 C--N 1.32 -0.342 0 C-N-CA 120.931 -0.652 . . . . 25.0 113.699 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.88 104.03 4.61 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.579 0.704 . . . . 25.0 109.449 177.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -72.7 126.23 90.82 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 106.376 -1.712 . . . . 25.0 106.376 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.09 171.13 18.91 Favored 'Trans proline' 0 C--N 1.344 0.294 0 N-CA-C 113.573 0.566 . . . . 25.0 113.573 -176.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.438 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.55 29.84 5.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.687 -1.227 . . . . 25.0 107.687 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.08 -15.04 0.35 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.894 1.678 . . . . 25.0 111.868 -173.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.438 ' H ' ' C ' ' A' ' 128' ' ' ALA . 68.4 mt-30 -129.0 154.69 46.37 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 103.416 -2.809 . . . . 25.0 103.416 170.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.4 t -140.48 94.98 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.577 0 N-CA-C 106.266 -1.753 . . . . 25.0 106.266 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -85.14 145.57 27.56 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 104.43 -2.433 . . . . 25.0 104.43 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.04 166.98 31.8 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.493 -1.685 . . . . 25.0 108.217 -178.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -136.14 154.3 51.02 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.383 -2.08 . . . . 25.0 105.383 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.95 160.55 30.92 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.769 -1.567 . . . . 25.0 106.769 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -103.38 115.55 30.76 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.018 0.199 . . . . 25.0 111.004 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.71 130.33 73.89 Favored Pre-proline 0 C--O 1.239 0.519 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 177.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.69 147.22 95.02 Favored 'Trans proline' 0 C--N 1.351 0.683 0 CA-C-O 121.729 0.637 . . . . 25.0 113.232 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.43 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.95 -24.22 38.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.188 -0.915 . . . . 25.0 112.554 -169.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.4 p-10 -85.02 9.57 14.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.65 -0.705 . . . . 25.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -113.51 56.91 0.68 Allowed 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.864 -1.161 . . . . 25.0 107.864 170.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.2 p -86.18 170.79 11.83 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 106.968 -1.493 . . . . 25.0 106.968 174.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 82.25 -165.42 44.94 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 116.926 1.53 . . . . 25.0 116.926 174.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.4 t -86.04 106.47 17.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.295 0.569 . . . . 25.0 110.962 -168.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.506 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.6 p-80 -157.96 172.43 18.46 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.082 -0.508 . . . . 25.0 111.306 -176.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 9.8 p -102.87 150.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.786 -1.19 . . . . 25.0 107.786 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 54.9 mt -134.84 129.6 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 N-CA-C 101.487 -3.523 . . . . 25.0 101.487 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -120.28 139.71 52.31 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 109.78 -0.452 . . . . 25.0 109.78 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -120.6 134.26 55.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.073 -0.714 . . . . 25.0 109.073 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.25 139.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 122.165 0.983 . . . . 25.0 112.02 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -109.45 113.2 25.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.299 -1.741 . . . . 25.0 106.299 175.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.67 122.22 35.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.735 -1.209 . . . . 25.0 107.735 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.8 mm -78.52 142.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.388 -0.597 . . . . 25.0 109.388 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.23 -43.19 24.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.819 0.736 . . . . 25.0 110.224 175.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.01 -23.47 65.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.755 -1.111 . . . . 25.0 113.898 -172.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 55.0 p -139.82 170.4 15.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.045 0.926 . . . . 25.0 110.299 -175.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.6 20.04 0.96 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.115 -0.948 . . . . 25.0 112.232 177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.13 146.07 24.57 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.617 -0.677 . . . . 25.0 112.491 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.41 143.46 11.87 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.385 -2.08 . . . . 25.0 105.385 172.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -146.6 130.9 17.53 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 111.772 0.286 . . . . 25.0 111.772 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -88.95 115.76 26.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.868 -0.605 . . . . 25.0 110.663 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.02 20.67 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.691 -0.855 . . . . 25.0 108.691 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -80.68 143.43 33.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 25.0 112.552 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -129.0 134.94 63.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 105.135 -2.172 . . . . 25.0 105.135 166.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -94.45 130.93 40.63 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.84 162.26 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 112.973 0.731 . . . . 25.0 112.973 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -120.38 95.12 4.6 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.362 -2.459 . . . . 25.0 104.362 167.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.445 HD23 HG22 ' A' ' 74' ' ' THR . 1.9 tp -90.5 162.81 14.88 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 113.274 0.842 . . . . 25.0 113.274 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.3 p -145.26 164.42 31.46 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.72 0 CA-C-O 117.966 -1.016 . . . . 25.0 110.785 -178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.2 m80 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.328 0.585 . . . . 25.0 110.648 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.59 169.79 38.38 Favored Glycine 0 CA--C 1.508 -0.357 1 N-CA-C 102.54 -4.224 . . . . 25.0 102.54 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 p90 -144.16 160.01 41.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 119.954 1.877 . . . . 25.0 110.461 178.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -97.24 121.14 47.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.48 -40.94 56.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.515 -1.22 . . . . 25.0 109.972 -174.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.6 t -153.7 128.68 4.88 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 105.77 -1.937 . . . . 25.0 105.77 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.19 130.6 11.28 Favored 'Cis proline' 0 C--N 1.348 0.512 0 C-N-CA 128.554 0.648 . . . . 25.0 111.099 -0.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.8 114.48 5.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.106 -0.497 . . . . 25.0 112.263 -172.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.1 t -71.86 158.64 35.69 Favored 'General case' 0 C--O 1.214 -0.775 0 N-CA-C 108.628 -0.878 . . . . 25.0 108.628 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -54.6 -26.33 31.93 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.578 0.751 . . . . 25.0 111.81 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.97 -53.45 38.75 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.678 0.752 . . . . 25.0 109.327 175.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.09 -34.86 78.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.733 -0.667 . . . . 25.0 110.558 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -63.45 -33.14 74.9 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 122.174 -0.329 . . . . 25.0 110.548 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -40.03 95.51 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.319 0.581 . . . . 25.0 109.617 177.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.422 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.7 tmtm? -68.3 -33.85 75.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.081 -0.509 . . . . 25.0 110.395 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.91 5.21 14.45 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.454 176.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 58.83 23.23 11.05 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.098 1.359 . . . . 25.0 113.053 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.484 ' C ' HD22 ' A' ' 19' ' ' ASN . 90.4 mt -88.44 -21.24 24.34 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.818 -1.178 . . . . 25.0 107.818 174.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.484 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -124.31 160.17 28.65 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 104.687 -2.338 . . . . 25.0 104.687 176.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.2 p -136.42 174.8 10.22 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.247 -0.279 . . . . 25.0 110.247 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 71.8 5.26 5.31 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.917 1.821 . . . . 25.0 115.917 173.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.3 m -67.35 -35.2 78.89 Favored 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 121.555 -0.716 . . . . 25.0 111.045 174.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.4 -64.3 1.38 Allowed Glycine 0 C--O 1.217 -0.918 0 O-C-N 123.818 0.699 . . . . 25.0 112.185 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 t -87.89 -54.09 4.42 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.621 1.2 . . . . 25.0 111.176 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.444 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.73 -8.27 10.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.151 -1.386 . . . . 25.0 113.164 -171.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.81 1.75 54.73 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.976 -0.453 . . . . 25.0 111.505 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -119.51 -34.88 3.68 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.713 -0.795 . . . . 25.0 110.427 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -127.12 100.57 26.77 Favored Pre-proline 0 C--O 1.241 0.636 0 C-N-CA 122.132 0.173 . . . . 25.0 111.163 169.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.422 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.2 Cg_endo -74.05 -21.28 18.36 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 117.141 -1.439 . . . . 25.0 114.505 -176.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -83.83 11.98 6.75 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.697 0.629 . . . . 25.0 112.697 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -68.99 -16.22 63.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.739 0.304 . . . . 25.0 111.77 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.68 137.69 24.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 113.983 1.105 . . . . 25.0 113.983 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -152.97 152.99 32.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 106.156 -1.794 . . . . 25.0 106.156 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -155.34 -168.31 18.27 Favored Glycine 0 C--O 1.229 -0.206 0 N-CA-C 108.694 -1.763 . . . . 25.0 108.694 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.6 tp -127.8 147.31 50.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 118.325 1.063 . . . . 25.0 111.704 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -66.47 156.89 33.52 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 172.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 1.84 3.84 Favored Glycine 0 C--O 1.225 -0.43 0 CA-C-N 114.962 -1.017 . . . . 25.0 113.255 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.95 145.1 77.05 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 121.732 -0.864 . . . . 25.0 109.691 -176.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -91.63 -16.07 18.36 Favored 'Cis proline' 0 CA--C 1.54 0.823 0 N-CA-C 115.119 1.161 . . . . 25.0 115.119 -6.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -71.8 -35.68 70.06 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.711 1.374 . . . . 25.0 114.711 -169.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.43 30.97 6.99 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.508 -2.034 . . . . 25.0 105.508 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.31 -173.43 40.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 114.259 -1.337 . . . . 25.0 111.131 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.11 171.61 4.91 Favored 'Trans proline' 0 C--O 1.242 0.685 0 C-N-CA 123.099 2.532 . . . . 25.0 113.713 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.01 159.94 31.15 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 106.649 -1.612 . . . . 25.0 106.649 173.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.42 138.81 58.27 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.385 -1.28 . . . . 25.0 107.864 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.83 -4.32 82.89 Favored Glycine 0 C--O 1.229 -0.214 0 CA-C-O 121.408 0.449 . . . . 25.0 112.794 -174.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -124.19 10.23 8.69 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.171 -0.678 . . . . 25.0 109.171 177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.0 mt -65.32 -50.16 74.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 O-C-N 122.361 -0.212 . . . . 25.0 111.509 -173.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.64 -20.35 58.56 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.811 -0.556 . . . . 25.0 110.124 178.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.0 p -83.54 -8.27 59.37 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.434 0.531 . . . . 25.0 112.434 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.42 34.02 14.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.627 0.771 . . . . 25.0 110.168 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.07 39.74 25.96 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.734 1.383 . . . . 25.0 114.734 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -120.74 134.4 55.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.174 0.59 . . . . 25.0 110.752 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -62.38 -34.34 76.51 Favored 'General case' 0 C--O 1.212 -0.898 0 N-CA-C 114.698 1.37 . . . . 25.0 114.698 -175.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 t -70.49 -8.33 50.35 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.488 0.551 . . . . 25.0 112.488 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.693 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -120.84 13.76 11.53 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.479 -1.304 . . . . 25.0 107.479 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -72.4 -37.18 68.75 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.056 -1.028 . . . . 25.0 110.455 -176.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -71.45 -13.7 61.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.721 0.772 . . . . 25.0 109.084 174.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.693 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.3 mp -90.17 -3.78 57.66 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.673 -0.694 . . . . 25.0 109.142 -178.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -113.95 -34.21 5.5 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.149 0.426 . . . . 25.0 112.149 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -92.82 119.91 32.64 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 121.596 -0.69 . . . . 25.0 110.312 -178.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.484 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -123.14 160.96 25.38 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.213 -0.903 . . . . 25.0 108.888 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.8 p -117.77 162.67 27.88 Favored Pre-proline 0 C--N 1.316 -0.857 1 N-CA-C 99.671 -4.196 . . . . 25.0 99.671 162.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.84 -4.91 14.29 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 116.782 -1.679 . . . . 25.0 115.687 -175.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.9 t -125.54 11.53 7.97 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.228 0.537 . . . . 25.0 111.783 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -77.46 -28.21 52.33 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.868 0.692 . . . . 25.0 112.868 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.484 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.5 m95 -125.88 165.41 18.78 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 110.145 -0.317 . . . . 25.0 110.145 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -66.87 126.54 29.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 105.23 -2.137 . . . . 25.0 105.23 168.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -94.86 104.89 16.79 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 100.294 -3.965 . . . . 25.0 100.294 177.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.79 134.87 54.03 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.654 -1.157 . . . . 25.0 110.098 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -93.26 99.37 11.93 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.585 -1.265 . . . . 25.0 107.585 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.9 mt -129.68 173.83 10.26 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 105.669 -1.975 . . . . 25.0 105.669 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -116.73 163.35 16.27 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -178.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.437 HG22 HD23 ' A' ' 168' ' ' LEU . 73.8 p -77.48 172.88 12.65 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.653 -1.612 . . . . 25.0 107.086 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 88.54 -162.62 31.94 Favored Glycine 0 C--O 1.24 0.479 0 N-CA-C 111.125 -0.79 . . . . 25.0 111.125 177.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -59.13 130.25 35.44 Favored 'Trans proline' 0 C--N 1.346 0.418 0 CA-C-N 118.8 1.3 . . . . 25.0 113.667 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -137.52 158.59 44.06 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 106.51 -1.663 . . . . 25.0 106.51 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 p -96.22 150.31 20.68 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 106.671 -1.603 . . . . 25.0 106.671 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -135.3 100.94 4.67 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 104.512 -2.403 . . . . 25.0 104.512 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.72 114.64 28.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.911 0.862 . . . . 25.0 109.521 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -100.08 146.99 26.14 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.3 -0.864 . . . . 25.0 109.492 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.31 114.39 18.19 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 103.624 -2.732 . . . . 25.0 103.624 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.8 mp -111.93 133.15 54.3 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.596 -0.729 . . . . 25.0 110.83 -172.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -99.19 17.85 18.92 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.763 0.792 . . . . 25.0 109.049 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -126.58 133.74 50.99 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.201 -0.666 . . . . 25.0 109.201 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -87.27 -17.21 33.06 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.535 0.939 . . . . 25.0 113.535 -177.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -73.1 162.05 29.91 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.956 0.724 . . . . 25.0 112.956 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.1 t -66.41 155.93 36.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 116.508 2.04 . . . . 25.0 116.508 -170.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 8.2 t -101.37 158.98 15.66 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.694 -1.225 . . . . 25.0 107.694 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -117.94 -17.22 9.79 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.302 0.482 . . . . 25.0 112.302 172.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.9 t -171.09 154.38 4.06 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.503 0.556 . . . . 25.0 112.503 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.8 m95 -128.8 140.71 51.58 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 104.64 -2.355 . . . . 25.0 104.64 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.6 mtt-85 -147.43 151.7 36.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.39 -0.967 . . . . 25.0 108.39 -179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -137.93 138.72 39.27 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.114 -1.439 . . . . 25.0 107.114 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -149.66 162.77 39.56 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.284 0.493 . . . . 25.0 109.92 176.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.99 164.96 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 N-CA-C 114.275 1.213 . . . . 25.0 114.275 -167.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 11.0 p -79.6 161.65 25.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.226 -1.027 . . . . 25.0 108.226 169.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -61.65 157.47 47.7 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.116 -0.947 . . . . 25.0 109.621 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.77 -18.44 36.96 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 117.444 -1.237 . . . . 25.0 114.072 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -120.73 31.93 6.21 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 122.791 0.436 . . . . 25.0 111.566 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.482 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -74.25 162.88 28.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.847 0.832 . . . . 25.0 111.434 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -83.64 101.06 11.24 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.736 -1.12 . . . . 25.0 110.172 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.482 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -84.81 14.09 5.16 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 116.597 2.073 . . . . 25.0 116.597 -171.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -117.93 1.91 12.1 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.833 -0.802 . . . . 25.0 108.833 175.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -105.09 158.48 32.0 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 107.832 -1.173 . . . . 25.0 107.832 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -66.65 159.44 51.0 Favored 'Trans proline' 0 C--N 1.344 0.327 0 O-C-N 122.024 0.486 . . . . 25.0 112.232 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.6 mp -71.96 101.9 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 25.0 110.641 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.6 p -98.63 159.76 14.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.449 -0.945 . . . . 25.0 108.449 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -65.42 -25.76 67.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.097 0.475 . . . . 25.0 110.964 178.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -24.97 61.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.648 -0.706 . . . . 25.0 112.277 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.7 m -79.29 -12.1 59.94 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.754 0.311 . . . . 25.0 111.82 -178.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 42.2 m-85 -99.17 155.04 17.68 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.16 1.541 . . . . 25.0 115.16 -174.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -94.43 95.63 8.98 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 102.619 -3.104 . . . . 25.0 102.619 163.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.9 mt -69.79 20.89 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 116.428 2.011 . . . . 25.0 116.428 -169.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.0 t -114.3 137.39 22.52 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.272 -0.64 . . . . 25.0 109.272 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.77 152.07 46.91 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.208 -2.728 . . . . 25.0 111.196 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -107.9 -6.69 16.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.972 0.415 . . . . 25.0 111.688 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 51.5 m -152.6 70.06 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.133 -0.485 . . . . 25.0 109.911 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -89.06 135.06 33.76 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 119.239 -0.984 . . . . 25.0 109.172 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.01 99.12 5.98 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.765 -2.309 . . . . 25.0 104.765 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -93.24 92.06 7.55 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.931 -0.766 . . . . 25.0 108.931 -177.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -107.42 117.06 33.1 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.671 -1.233 . . . . 25.0 107.671 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -102.55 80.58 0.37 Allowed Glycine 0 CA--C 1.503 -0.703 0 CA-C-N 115.799 -0.637 . . . . 25.0 113.519 -170.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.43 15.87 5.8 Favored Glycine 0 C--N 1.322 -0.237 0 C-N-CA 120.96 -0.638 . . . . 25.0 113.264 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.48 105.59 4.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.358 0.599 . . . . 25.0 109.585 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 88.8 mt -72.29 122.59 87.83 Favored Pre-proline 0 C--N 1.321 -0.673 0 N-CA-C 105.384 -2.08 . . . . 25.0 105.384 175.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.94 167.24 26.55 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 117.864 -0.957 . . . . 25.0 113.826 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.4 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -96.32 25.8 4.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.291 -1.003 . . . . 25.0 108.291 175.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.65 -12.36 0.46 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.822 1.649 . . . . 25.0 112.168 -174.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 128' ' ' ALA . 63.7 mt-30 -130.12 152.2 49.83 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 104.046 -2.576 . . . . 25.0 104.046 169.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.1 t -142.94 95.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.843 -1.54 . . . . 25.0 106.843 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.0 t -86.94 141.09 28.97 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.199 -2.148 . . . . 25.0 105.199 174.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.52 167.0 26.53 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 105.513 -2.032 . . . . 25.0 105.513 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -134.08 152.02 51.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.04 -2.208 . . . . 25.0 105.04 172.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.3 160.33 35.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.441 -1.318 . . . . 25.0 107.441 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -103.43 116.0 31.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.597 -0.274 . . . . 25.0 111.018 -176.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.2 mt -77.28 131.24 72.56 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 107.287 -1.375 . . . . 25.0 107.287 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -60.91 144.21 99.52 Favored 'Trans proline' 0 C--N 1.352 0.726 0 N-CA-C 113.919 0.7 . . . . 25.0 113.919 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -79.23 -28.2 42.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.182 -0.917 . . . . 25.0 112.514 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -82.35 10.25 7.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.733 0.778 . . . . 25.0 110.133 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -117.78 53.43 0.94 Allowed 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.553 -1.277 . . . . 25.0 107.553 171.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.95 11.82 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 106.398 -1.704 . . . . 25.0 106.398 174.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.95 -165.15 41.47 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 116.262 1.265 . . . . 25.0 116.262 176.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.0 t -86.02 108.61 18.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.446 0.641 . . . . 25.0 111.012 -168.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.408 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 44.0 p-80 -159.39 172.36 18.07 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 115.784 -0.644 . . . . 25.0 110.921 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -109.06 152.04 11.23 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 108.219 -1.03 . . . . 25.0 108.219 -179.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 67.8 mt -134.44 123.22 42.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 104.229 -2.508 . . . . 25.0 104.229 -178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.54 127.7 52.33 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 122.899 0.479 . . . . 25.0 110.261 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -111.54 129.36 56.08 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 108.816 -0.809 . . . . 25.0 108.816 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.7 p -126.72 139.75 50.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 122.172 0.987 . . . . 25.0 111.92 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 9.7 t90 -117.13 124.12 48.4 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.56 126.52 49.65 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.597 -0.52 . . . . 25.0 109.597 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 35.9 mm -77.85 142.47 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.208 -0.664 . . . . 25.0 109.208 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.93 -45.55 20.25 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.929 0.786 . . . . 25.0 110.678 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.17 -21.25 64.9 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.575 1.324 . . . . 25.0 114.575 -172.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 50.0 p -138.59 169.09 18.4 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.915 0.864 . . . . 25.0 109.577 -175.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.7 19.67 0.81 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.257 -0.883 . . . . 25.0 112.244 178.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.1 142.65 27.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -176.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.46 141.1 14.46 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 171.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -140.81 135.41 31.4 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.501 0.556 . . . . 25.0 112.501 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -93.65 112.47 24.35 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.449 -0.796 . . . . 25.0 111.149 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -97.15 108.21 20.89 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.971 -0.752 . . . . 25.0 108.971 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.11 141.75 33.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.744 -0.662 . . . . 25.0 111.737 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.8 tt -125.27 132.88 70.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 105.553 -2.017 . . . . 25.0 105.553 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -96.46 129.42 43.83 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.523 -1.288 . . . . 25.0 107.523 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.9 m -133.3 162.31 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.666 0.987 . . . . 25.0 113.666 -174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.49 94.93 4.73 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.652 -2.721 . . . . 25.0 103.652 164.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.437 HD23 HG22 ' A' ' 74' ' ' THR . 2.9 tp -91.29 156.86 17.49 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 112.844 0.683 . . . . 25.0 112.844 -170.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.4 p -145.76 168.06 21.65 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.998 -0.439 . . . . 25.0 110.886 175.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.767 0 CA-C-O 118.711 -0.661 . . . . 25.0 110.602 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 121.012 0.434 . . . . 25.0 110.548 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 170.92 169.4 33.9 Favored Glycine 0 CA--C 1.509 -0.327 1 N-CA-C 101.872 -4.491 . . . . 25.0 101.872 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -145.75 161.49 39.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 120.188 1.994 . . . . 25.0 110.278 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -97.99 122.96 50.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.809 -1.182 . . . . 25.0 107.809 177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -73.19 -43.34 61.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.999 -1.001 . . . . 25.0 109.424 -176.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.7 t -153.29 131.36 6.33 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 106.16 -1.793 . . . . 25.0 106.16 177.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -64.96 134.18 19.1 Favored 'Cis proline' 0 CA--C 1.533 0.467 0 C-N-CA 128.498 0.624 . . . . 25.0 111.395 -0.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.26 109.83 2.81 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.001 -0.545 . . . . 25.0 112.239 -172.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.6 t -71.94 157.55 37.63 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.947 -0.76 . . . . 25.0 108.947 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -55.86 -24.36 36.34 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.439 0.695 . . . . 25.0 111.812 178.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.54 -53.28 36.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.711 0.767 . . . . 25.0 109.279 176.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.01 -37.18 85.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.489 -0.778 . . . . 25.0 110.277 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -62.97 -32.82 74.23 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 120.991 -0.284 . . . . 25.0 110.814 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.05 94.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.086 0.47 . . . . 25.0 110.53 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.468 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.0 tmtm? -70.07 -33.42 71.9 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.05 0.452 . . . . 25.0 110.047 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.4 mt -76.65 3.62 11.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.481 174.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 58.37 23.03 10.09 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.39 1.476 . . . . 25.0 113.05 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.439 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.8 mt -85.86 -22.28 27.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.196 -1.409 . . . . 25.0 107.196 173.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.439 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.5 m120 -123.3 158.78 30.23 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 105.004 -2.221 . . . . 25.0 105.004 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.6 p -135.95 177.76 7.58 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.463 -0.569 . . . . 25.0 109.463 -176.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 72.02 4.97 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.498 1.666 . . . . 25.0 115.498 173.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.4 m -69.95 -37.15 75.76 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.484 -0.76 . . . . 25.0 111.647 174.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.22 -63.5 1.72 Allowed Glycine 0 C--O 1.219 -0.838 0 O-C-N 123.474 0.484 . . . . 25.0 112.192 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.0 t -88.04 -53.33 4.78 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.392 1.092 . . . . 25.0 111.544 -178.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.9 OUTLIER -68.4 -10.56 13.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.447 -1.251 . . . . 25.0 113.054 -171.723 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -87.71 2.28 51.54 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.902 -0.499 . . . . 25.0 112.101 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -120.07 -34.74 3.62 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.756 -0.778 . . . . 25.0 110.677 172.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.05 105.32 22.32 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.288 -0.634 . . . . 25.0 109.288 169.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.468 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 86.9 Cg_endo -76.1 -20.23 14.93 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 116.326 -1.983 . . . . 25.0 114.16 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -85.0 12.11 8.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.555 0.576 . . . . 25.0 112.555 -178.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.0 m -68.79 -12.13 61.15 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.859 0.361 . . . . 25.0 111.966 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.09 133.65 29.52 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 CA-C-O 121.877 0.846 . . . . 25.0 112.734 -178.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -152.85 153.93 34.08 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.882 -1.525 . . . . 25.0 106.882 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.53 -172.43 26.69 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 109.339 -1.504 . . . . 25.0 109.339 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.4 tp -124.28 151.49 44.16 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 117.848 0.824 . . . . 25.0 111.774 -177.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -64.26 156.99 27.15 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.772 -1.196 . . . . 25.0 107.772 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.17 -2.68 3.25 Favored Glycine 0 C--O 1.223 -0.565 0 CA-C-N 114.517 -1.22 . . . . 25.0 113.028 178.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -75.76 138.89 69.89 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 121.407 -1.054 . . . . 25.0 110.522 -175.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -92.71 -15.76 16.73 Favored 'Cis proline' 0 CA--C 1.543 0.955 0 N-CA-C 115.609 1.35 . . . . 25.0 115.609 -6.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -71.05 -35.35 71.92 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.412 1.634 . . . . 25.0 115.412 -168.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.07 32.74 5.71 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.938 -1.875 . . . . 25.0 105.938 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.21 -174.28 40.57 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 114.407 -1.27 . . . . 25.0 111.496 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.98 170.87 4.28 Favored 'Trans proline' 0 C--O 1.241 0.637 0 C-N-CA 123.212 2.608 . . . . 25.0 113.359 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.13 159.96 31.03 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.2 -1.407 . . . . 25.0 107.2 174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -60.86 139.19 58.04 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.424 -1.262 . . . . 25.0 107.96 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.39 -5.66 76.34 Favored Glycine 0 C--O 1.23 -0.12 0 CA-C-O 121.704 0.613 . . . . 25.0 112.874 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 20.3 m170 -126.43 9.21 7.18 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 71.4 mt -65.96 -49.7 74.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.276 -0.265 . . . . 25.0 111.161 -174.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.17 -21.26 58.89 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 121.842 -0.536 . . . . 25.0 109.774 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 25.1 p -83.4 -6.58 59.5 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.758 0.651 . . . . 25.0 112.758 -178.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.78 32.6 12.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.544 0.738 . . . . 25.0 110.209 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.45 35.78 22.97 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.636 1.347 . . . . 25.0 114.636 -177.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -120.56 141.19 50.51 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.999 0.52 . . . . 25.0 111.743 176.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -65.35 -35.27 80.47 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.0 -6.85 45.13 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.348 0.594 . . . . 25.0 112.353 -177.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.675 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.2 m-85 -120.45 12.66 11.66 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 107.226 -1.398 . . . . 25.0 107.226 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -71.77 -36.02 70.23 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.893 -1.129 . . . . 25.0 110.112 -175.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -71.38 -14.47 62.18 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.834 0.826 . . . . 25.0 109.967 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.675 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.9 mp -87.48 -7.59 57.44 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.405 -0.961 . . . . 25.0 108.405 -178.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -112.35 -31.99 6.65 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-O 120.959 0.409 . . . . 25.0 112.006 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -94.94 122.1 37.23 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 121.66 -0.65 . . . . 25.0 109.898 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.439 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -130.0 160.97 32.02 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.423 -0.955 . . . . 25.0 108.423 177.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.4 p -117.05 163.6 22.32 Favored Pre-proline 0 C--N 1.32 -0.71 1 N-CA-C 99.778 -4.156 . . . . 25.0 99.778 162.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.13 -2.29 9.46 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 116.473 -1.885 . . . . 25.0 115.936 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.4 t -128.03 11.1 6.5 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.512 0.673 . . . . 25.0 111.831 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -79.12 -29.19 43.05 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.179 -0.951 . . . . 25.0 113.549 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.439 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 9.2 m95 -125.71 166.88 15.97 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.957 -0.386 . . . . 25.0 109.957 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -66.55 118.58 10.36 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 106.842 -1.54 . . . . 25.0 106.842 172.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.5 mmtt -92.4 103.65 16.06 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 100.624 -3.843 . . . . 25.0 100.624 176.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.18 135.03 53.95 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 114.8 -1.091 . . . . 25.0 110.195 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -92.88 99.96 12.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.562 -1.199 . . . . 25.0 107.799 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.8 mt -131.7 173.95 10.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.558 -1.645 . . . . 25.0 106.558 -175.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -114.79 163.22 15.81 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.929 1.085 . . . . 25.0 113.929 -179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.431 HG21 ' HA ' ' A' ' 139' ' ' ALA . 74.5 p -76.96 168.58 19.86 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 105.958 -1.867 . . . . 25.0 105.958 173.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.71 -161.14 24.7 Favored Glycine 0 C--O 1.24 0.514 0 N-CA-C 110.619 -0.993 . . . . 25.0 110.619 -178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.85 131.11 41.87 Favored 'Trans proline' 0 C--N 1.346 0.443 0 CA-C-N 119.1 1.45 . . . . 25.0 114.437 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -140.07 159.71 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.816 -1.55 . . . . 25.0 106.816 178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.6 p -105.84 150.9 25.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.751 -1.204 . . . . 25.0 107.751 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -137.34 100.89 4.37 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 105.083 -2.191 . . . . 25.0 105.083 -179.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.03 116.83 32.73 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.909 0.862 . . . . 25.0 109.811 -176.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -103.26 150.54 23.63 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.262 -0.881 . . . . 25.0 110.635 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -127.76 115.41 18.64 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 103.964 -2.606 . . . . 25.0 103.964 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.3 mp -116.04 124.38 50.31 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 113.009 0.744 . . . . 25.0 113.009 -172.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.1 t -88.23 -1.93 58.3 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.05 0.452 . . . . 25.0 110.59 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -116.16 119.97 37.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.21 -0.663 . . . . 25.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.4 mmm180 -84.3 -0.13 51.28 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.925 1.454 . . . . 25.0 114.925 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.13 155.39 39.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 117.741 0.246 . . . . 25.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.6 t -74.14 155.95 37.87 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 114.879 1.437 . . . . 25.0 114.879 -171.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 7.3 t -90.73 162.61 14.82 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.01 -0.995 . . . . 25.0 108.552 173.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -117.89 -14.52 10.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.922 -0.769 . . . . 25.0 108.922 168.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 t -175.2 154.41 1.75 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.006 0.431 . . . . 25.0 111.213 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.1 m95 -116.99 130.65 56.83 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.861 -2.644 . . . . 25.0 103.861 165.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 53.0 mtt-85 -133.59 147.46 51.52 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.953 -1.128 . . . . 25.0 107.953 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -137.37 132.24 33.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 106.627 -1.62 . . . . 25.0 106.627 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.99 164.86 33.34 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.368 0.531 . . . . 25.0 110.69 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 167.99 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 113.249 0.833 . . . . 25.0 113.249 -167.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.3 p -83.76 161.5 20.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.879 -1.156 . . . . 25.0 107.879 168.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -61.88 158.19 44.92 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.159 -0.928 . . . . 25.0 109.796 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.79 -18.34 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 117.557 -1.162 . . . . 25.0 114.739 -173.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -120.84 31.71 6.29 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.166 0.432 . . . . 25.0 112.166 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -76.34 165.17 25.23 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.653 0.74 . . . . 25.0 110.889 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -87.54 101.02 13.22 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.167 -0.924 . . . . 25.0 110.272 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -79.09 18.54 0.64 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 115.749 1.759 . . . . 25.0 115.749 -174.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 15.8 t -117.77 -2.46 11.38 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.328 -0.619 . . . . 25.0 109.328 175.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -101.67 157.4 33.75 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.367 -0.833 . . . . 25.0 108.91 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -66.63 157.66 59.77 Favored 'Trans proline' 0 C--N 1.346 0.441 0 O-C-N 121.94 0.442 . . . . 25.0 112.233 178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.2 mp -72.64 105.45 4.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.507 0.67 . . . . 25.0 111.174 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 68.3 p -99.34 157.07 16.66 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.008 -0.738 . . . . 25.0 109.008 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -65.95 -26.13 67.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.139 0.495 . . . . 25.0 110.873 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.96 -24.99 60.86 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.506 -0.77 . . . . 25.0 112.239 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.1 t -83.44 -11.1 57.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.985 0.421 . . . . 25.0 111.54 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -94.18 156.71 16.41 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.715 1.006 . . . . 25.0 113.715 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -97.21 96.12 8.21 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 102.826 -3.027 . . . . 25.0 102.826 162.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.37 -7.54 32.24 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.711 1.004 . . . . 25.0 113.711 -171.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.76 122.7 78.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 108.124 -1.065 . . . . 25.0 108.124 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.91 139.79 36.97 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 115.362 -2.625 . . . . 25.0 111.996 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -87.7 -15.56 36.77 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.392 0.516 . . . . 25.0 112.392 -175.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.5 m -149.31 66.68 1.02 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.427 -0.351 . . . . 25.0 110.668 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -89.09 139.23 30.68 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 118.426 -1.31 . . . . 25.0 109.336 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -118.19 100.93 7.84 Favored 'General case' 0 CA--C 1.496 -1.113 0 N-CA-C 101.225 -3.62 . . . . 25.0 101.225 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -88.56 92.12 9.07 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 105.571 -2.011 . . . . 25.0 105.571 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.83 117.64 33.36 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.736 -1.579 . . . . 25.0 106.736 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -99.97 81.12 0.51 Allowed Glycine 0 CA--C 1.5 -0.855 0 CA-C-N 115.441 -0.8 . . . . 25.0 111.798 -173.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.21 16.85 5.54 Favored Glycine 0 C--N 1.32 -0.33 0 C-N-CA 120.86 -0.686 . . . . 25.0 114.283 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.87 104.18 5.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.629 -0.878 . . . . 25.0 108.629 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -75.84 127.56 85.24 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 107.54 -1.281 . . . . 25.0 107.54 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -71.44 153.77 60.79 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 117.985 -0.877 . . . . 25.0 113.842 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -98.8 30.88 3.14 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.982 -1.488 . . . . 25.0 106.982 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 72.74 -18.8 0.33 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.041 1.737 . . . . 25.0 111.705 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -129.23 151.51 49.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 104.941 -2.244 . . . . 25.0 104.941 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 47.6 t -144.08 95.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.495 -1.298 . . . . 25.0 107.495 -178.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -91.42 133.7 35.25 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 107.353 -1.351 . . . . 25.0 107.353 174.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 163.22 31.3 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 104.975 -2.231 . . . . 25.0 104.975 177.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -136.93 149.62 47.71 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 105.341 -2.096 . . . . 25.0 105.341 174.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.76 163.95 31.88 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.668 -1.234 . . . . 25.0 107.668 -178.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -102.01 118.78 37.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.439 0.162 . . . . 25.0 111.125 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.4 mt -76.25 132.23 73.69 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 107.139 -1.43 . . . . 25.0 107.139 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -63.34 147.53 93.54 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-O 121.692 0.622 . . . . 25.0 113.576 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.03 -26.15 43.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.25 -0.886 . . . . 25.0 112.769 -169.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -82.09 7.24 13.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.602 0.715 . . . . 25.0 110.113 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -114.44 52.29 0.84 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 107.812 -1.181 . . . . 25.0 107.812 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.97 170.92 11.86 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 106.041 -1.836 . . . . 25.0 106.041 173.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 85.68 -168.65 41.94 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 116.116 1.206 . . . . 25.0 116.116 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.15 109.14 18.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.45 0.643 . . . . 25.0 110.881 -169.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.461 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.8 p-80 -158.24 171.32 20.41 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.91 -0.586 . . . . 25.0 111.406 -176.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.7 p -102.92 150.2 6.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 107.315 -1.365 . . . . 25.0 107.315 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.1 mt -133.21 127.81 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 102.201 -3.259 . . . . 25.0 102.201 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.0 mp -119.96 141.27 49.81 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.848 -0.614 . . . . 25.0 109.657 -178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.59 140.43 52.12 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.987 -0.745 . . . . 25.0 108.987 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 4.2 p -127.32 135.84 62.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 122.059 0.933 . . . . 25.0 112.325 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.404 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.7 t90 -95.11 111.43 23.25 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 104.876 -2.268 . . . . 25.0 104.876 170.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -98.16 119.33 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.011 -1.477 . . . . 25.0 107.011 -177.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.6 mm -86.44 141.35 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -170.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -83.52 -46.53 12.34 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.348 0.594 . . . . 25.0 110.848 175.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.16 -27.05 66.09 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.788 1.403 . . . . 25.0 114.788 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 67.2 p -138.06 164.29 29.47 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.172 -0.677 . . . . 25.0 109.172 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -77.85 26.79 0.18 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.621 0.971 . . . . 25.0 113.621 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -96.05 148.96 22.12 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.574 -0.704 . . . . 25.0 112.59 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.41 138.24 9.73 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 106.373 -1.714 . . . . 25.0 106.373 170.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -146.86 131.45 17.79 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.242 0.474 . . . . 25.0 112.204 178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -91.18 118.01 30.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.156 -0.475 . . . . 25.0 111.449 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -96.99 113.92 25.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.423 -0.954 . . . . 25.0 108.423 178.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.47 142.95 27.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.746 -0.661 . . . . 25.0 112.713 -175.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.47 136.77 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 105.032 -2.21 . . . . 25.0 105.032 167.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -97.17 131.58 43.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.68 162.83 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 113.049 0.759 . . . . 25.0 113.049 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -120.06 95.07 4.6 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 104.692 -2.336 . . . . 25.0 104.692 167.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.424 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.86 161.09 15.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 113.158 0.799 . . . . 25.0 113.158 -171.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 66.0 p -145.85 166.45 25.93 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.83 -0.804 . . . . 25.0 108.83 175.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.755 0 CA-C-O 118.827 -0.606 . . . . 25.0 110.408 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 19.6 m80 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.471 0.653 . . . . 25.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.5 170.87 38.9 Favored Glycine 0 CA--C 1.509 -0.307 1 N-CA-C 101.282 -4.727 . . . . 25.0 101.282 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -141.72 154.92 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 120.144 1.972 . . . . 25.0 109.787 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -94.31 119.61 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 106.019 -1.845 . . . . 25.0 106.019 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.32 -44.61 36.05 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.314 -1.312 . . . . 25.0 110.338 -172.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -148.46 124.55 5.27 Favored Pre-proline 0 C--N 1.319 -0.719 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -64.65 131.4 12.08 Favored 'Cis proline' 0 CA--C 1.536 0.617 0 C-N-CA 128.7 0.708 . . . . 25.0 111.766 -0.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.84 112.51 4.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -173.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 t -71.98 158.42 36.03 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.576 -0.528 . . . . 25.0 109.576 -178.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -55.33 -25.43 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.714 0.806 . . . . 25.0 112.08 178.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.33 -51.47 52.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.64 0.733 . . . . 25.0 109.296 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.13 -37.03 84.7 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.719 -0.673 . . . . 25.0 109.977 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.7 -32.46 73.56 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 122.344 -0.223 . . . . 25.0 110.97 178.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -40.82 96.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.275 0.559 . . . . 25.0 110.323 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.438 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.6 tmtm? -68.15 -34.44 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.27 0.557 . . . . 25.0 109.812 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.7 mt -78.0 6.58 7.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.043 -0.526 . . . . 25.0 111.681 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 59.15 23.19 11.43 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.218 1.407 . . . . 25.0 113.342 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.499 ' C ' HD22 ' A' ' 19' ' ' ASN . 90.2 mt -90.09 -21.08 22.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.491 -0.929 . . . . 25.0 108.491 174.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.499 HD22 ' C ' ' A' ' 18' ' ' LEU . 1.8 m120 -123.54 159.97 28.01 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 106.097 -1.816 . . . . 25.0 106.097 178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 p -135.69 174.59 10.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.566 0.347 . . . . 25.0 111.126 -175.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 66.93 4.99 3.78 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 116.855 2.169 . . . . 25.0 116.855 178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.0 m -64.89 -38.99 92.83 Favored 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 121.664 -0.648 . . . . 25.0 111.261 174.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.57 1.58 Allowed Glycine 0 C--O 1.217 -0.948 0 O-C-N 123.733 0.646 . . . . 25.0 111.92 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 t -88.07 -52.27 5.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.574 1.178 . . . . 25.0 110.994 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -7.13 7.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.33 -1.305 . . . . 25.0 113.53 -171.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -90.74 -0.74 57.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.851 -0.531 . . . . 25.0 111.302 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -116.39 -34.02 4.75 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.259 -0.577 . . . . 25.0 109.748 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -126.94 102.44 24.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.461 -0.57 . . . . 25.0 109.461 171.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.438 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 92.6 Cg_endo -74.37 -20.54 18.34 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 117.383 -1.278 . . . . 25.0 113.955 -174.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -87.03 14.96 6.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.432 0.53 . . . . 25.0 112.432 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 61.5 m -65.09 -21.33 66.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.989 0.424 . . . . 25.0 111.651 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.67 125.96 22.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 115.274 1.583 . . . . 25.0 115.274 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -152.93 159.77 42.99 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.127 -1.805 . . . . 25.0 106.127 172.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.01 -167.47 21.51 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 107.661 -2.176 . . . . 25.0 107.661 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -119.33 150.67 39.76 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 118.31 1.055 . . . . 25.0 111.916 -177.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -65.29 152.85 42.74 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.089 -1.448 . . . . 25.0 107.089 172.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.14 2.07 1.65 Allowed Glycine 0 C--N 1.317 -0.498 0 CA-C-N 115.091 -0.958 . . . . 25.0 114.153 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -75.97 140.64 70.5 Favored Pre-proline 0 C--N 1.322 -0.619 0 O-C-N 121.605 -0.938 . . . . 25.0 109.369 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -93.23 -13.45 20.46 Favored 'Cis proline' 0 CA--C 1.544 0.976 0 C-N-CA 130.473 1.447 . . . . 25.0 115.607 -6.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.84 -37.42 76.17 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.489 1.292 . . . . 25.0 114.489 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.48 30.5 7.26 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 105.306 -2.109 . . . . 25.0 105.306 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.57 -179.93 44.83 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 114.384 -1.28 . . . . 25.0 110.79 -177.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -62.54 173.35 3.6 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.985 2.457 . . . . 25.0 113.356 177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 160.04 31.05 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 107.207 -1.405 . . . . 25.0 107.207 173.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -60.66 139.69 57.75 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 107.204 -1.406 . . . . 25.0 107.204 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.51 -5.89 79.35 Favored Glycine 0 CA--C 1.511 -0.184 0 CA-C-N 116.232 -0.44 . . . . 25.0 112.628 -174.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -124.97 8.86 8.08 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 122.517 -0.402 . . . . 25.0 109.954 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.32 -49.48 80.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 122.047 -0.408 . . . . 25.0 111.502 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.33 -16.96 59.64 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 121.992 -0.442 . . . . 25.0 110.102 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.7 p -87.28 -7.56 57.71 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.599 0.592 . . . . 25.0 112.599 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.02 30.89 10.14 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.521 0.729 . . . . 25.0 110.464 -172.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.97 37.25 24.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.357 1.243 . . . . 25.0 114.357 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.2 135.71 54.89 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.938 0.495 . . . . 25.0 110.807 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 p -61.44 -34.78 76.0 Favored 'General case' 0 C--O 1.213 -0.827 0 N-CA-C 114.627 1.343 . . . . 25.0 114.627 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -69.2 -8.56 46.86 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.676 0.621 . . . . 25.0 112.676 -178.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.691 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.6 m-85 -122.68 12.48 9.92 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 108.123 -1.065 . . . . 25.0 108.123 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -70.71 -39.58 73.36 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 120.901 -1.125 . . . . 25.0 111.176 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -73.38 -11.06 60.35 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.697 0.761 . . . . 25.0 109.423 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' HA ' ' A' ' 56' ' ' PHE . 2.1 mp -88.14 -3.09 58.93 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.768 -0.826 . . . . 25.0 108.768 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -114.11 -34.02 5.5 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.973 0.416 . . . . 25.0 111.357 172.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -86.6 116.1 24.5 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 121.78 -0.575 . . . . 25.0 110.375 -178.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.462 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 2.8 pm0 -125.46 160.9 28.31 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.401 0.619 . . . . 25.0 110.658 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 64.1 p -119.88 160.22 43.56 Favored Pre-proline 0 C--N 1.317 -0.816 1 N-CA-C 99.719 -4.178 . . . . 25.0 99.719 160.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -70.17 -2.63 10.79 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 N-CA-C 116.094 1.536 . . . . 25.0 116.094 -173.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.4 t -121.21 9.76 10.51 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.182 0.515 . . . . 25.0 111.361 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -79.65 -28.66 40.84 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.243 0.831 . . . . 25.0 113.243 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.2 m95 -126.6 168.35 14.43 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.773 0.321 . . . . 25.0 111.259 -176.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.0 t-20 -69.6 119.38 13.75 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 106.75 -1.574 . . . . 25.0 106.75 171.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.3 mmtt -93.29 103.08 15.35 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 101.183 -3.636 . . . . 25.0 101.183 177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.79 135.58 55.07 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.917 -1.038 . . . . 25.0 110.621 -177.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -89.69 102.41 15.1 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.177 -178.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.6 173.85 10.48 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.577 -1.268 . . . . 25.0 107.577 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.16 157.36 24.93 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.937 -0.574 . . . . 25.0 111.243 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 139' ' ' ALA . 76.4 p -76.96 168.83 19.42 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 106.877 -1.527 . . . . 25.0 106.877 171.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.93 -160.93 26.56 Favored Glycine 0 C--O 1.239 0.468 0 N-CA-C 110.424 -1.071 . . . . 25.0 110.424 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.95 131.51 42.16 Favored 'Trans proline' 0 C--N 1.347 0.449 0 CA-C-N 119.061 1.43 . . . . 25.0 114.177 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -137.91 161.94 35.34 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 106.7 -1.592 . . . . 25.0 106.7 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.8 p -103.39 149.49 24.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.392 -1.336 . . . . 25.0 107.392 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -137.57 101.06 4.38 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.042 -2.207 . . . . 25.0 105.042 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.8 113.99 27.87 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.224 1.011 . . . . 25.0 110.046 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -95.48 146.94 24.06 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.028 -0.987 . . . . 25.0 108.697 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -124.97 114.45 19.15 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 103.655 -2.72 . . . . 25.0 103.655 179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.12 138.51 48.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.477 -0.783 . . . . 25.0 110.037 -173.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.0 t -101.0 14.53 31.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.241 1.02 . . . . 25.0 109.136 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.5 134.85 29.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.899 -0.591 . . . . 25.0 110.079 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -90.1 5.65 45.87 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.588 0.588 . . . . 25.0 112.588 -179.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.79 153.25 42.38 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.904 -0.406 . . . . 25.0 109.904 178.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 t -74.36 156.07 37.47 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.264 1.209 . . . . 25.0 114.264 -170.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -102.93 157.42 16.99 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -118.01 -14.93 9.97 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 111.541 0.2 . . . . 25.0 111.541 173.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.5 t -172.45 154.26 3.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.975 0.417 . . . . 25.0 111.897 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -126.63 139.05 53.47 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 104.3 -2.481 . . . . 25.0 104.3 167.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 16.8 mtt-85 -144.9 150.61 37.34 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.446 -0.946 . . . . 25.0 108.446 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -137.69 136.22 37.2 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.333 -1.728 . . . . 25.0 106.333 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -148.52 162.43 39.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.515 0.598 . . . . 25.0 110.022 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.99 166.0 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 113.478 0.918 . . . . 25.0 113.478 -167.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 13.2 p -80.98 162.39 23.86 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.688 -1.227 . . . . 25.0 107.688 169.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -62.39 158.39 48.58 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.31 -0.859 . . . . 25.0 108.994 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.03 -23.33 34.25 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 116.565 -1.823 . . . . 25.0 114.272 -173.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -113.87 32.06 6.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.576 0.351 . . . . 25.0 111.499 -175.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.4 p-90 -76.14 164.31 26.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.98 0.895 . . . . 25.0 112.541 -176.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -83.04 100.93 10.79 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.523 -1.217 . . . . 25.0 110.101 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.09 12.88 10.43 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.662 2.097 . . . . 25.0 116.662 -170.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.7 t -121.08 7.91 10.35 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.561 -0.903 . . . . 25.0 108.561 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -111.22 159.52 32.51 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 107.388 -1.338 . . . . 25.0 107.388 -174.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 158.04 57.04 Favored 'Trans proline' 0 C--N 1.346 0.435 0 O-C-N 121.894 0.418 . . . . 25.0 113.08 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 mp -70.59 106.32 3.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.898 0.38 . . . . 25.0 110.522 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -103.42 153.66 20.26 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.808 -0.812 . . . . 25.0 108.808 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -64.69 -25.14 67.82 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.0 0.429 . . . . 25.0 111.484 177.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.12 64.02 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.623 -0.717 . . . . 25.0 112.221 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.1 t -80.66 -21.06 41.74 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.632 0.73 . . . . 25.0 110.983 -178.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 26.1 m-85 -86.56 152.1 22.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 115.2 1.555 . . . . 25.0 115.2 -176.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -95.67 92.82 6.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 102.692 -3.077 . . . . 25.0 102.692 163.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.42 -6.25 13.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.937 1.458 . . . . 25.0 114.937 -170.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -84.93 131.68 48.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 109.17 -0.678 . . . . 25.0 109.17 177.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.66 140.91 27.07 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 115.779 -2.347 . . . . 25.0 112.369 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -92.16 -11.87 34.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.382 0.512 . . . . 25.0 112.382 -177.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 53.4 m -148.98 66.75 1.04 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.503 0.321 . . . . 25.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -88.99 133.52 34.3 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 118.357 -1.337 . . . . 25.0 109.027 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -118.89 99.08 6.52 Favored 'General case' 0 CA--C 1.499 -1.017 0 N-CA-C 102.715 -3.069 . . . . 25.0 102.715 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -91.53 91.95 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.446 -1.687 . . . . 25.0 106.446 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -110.45 117.28 33.15 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.808 -1.182 . . . . 25.0 107.808 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.01 78.67 0.87 Allowed Glycine 0 CA--C 1.502 -0.772 0 CA-C-N 115.072 -0.967 . . . . 25.0 113.787 -169.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.59 22.21 6.82 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 121.015 -0.612 . . . . 25.0 113.906 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.67 106.71 4.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.802 0.811 . . . . 25.0 109.284 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 80.6 mt -71.32 122.87 88.3 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.975 -1.121 . . . . 25.0 107.975 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -77.92 168.36 22.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 N-CA-C 114.633 0.974 . . . . 25.0 114.633 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -109.21 33.26 4.38 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.694 -0.854 . . . . 25.0 108.694 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.83 -18.36 0.31 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.823 1.649 . . . . 25.0 112.76 -177.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -128.58 152.8 47.91 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 104.823 -2.288 . . . . 25.0 104.823 168.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -140.49 95.02 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.0 m -94.85 122.75 37.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 107.109 -1.441 . . . . 25.0 107.109 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -130.69 167.05 19.44 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 105.73 -1.952 . . . . 25.0 105.73 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -130.31 151.0 51.29 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 105.256 -2.128 . . . . 25.0 105.256 175.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.44 160.5 38.4 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.219 -1.401 . . . . 25.0 107.219 -177.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -103.28 115.8 31.24 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.091 0.245 . . . . 25.0 111.072 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.2 mt -76.29 132.45 73.14 Favored Pre-proline 0 CA--C 1.539 0.551 0 N-CA-C 107.508 -1.293 . . . . 25.0 107.508 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.47 146.74 96.79 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-O 121.699 0.625 . . . . 25.0 113.519 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.96 -24.91 37.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.219 -0.9 . . . . 25.0 112.658 -168.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -85.46 10.42 12.97 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.622 0.725 . . . . 25.0 110.103 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.2 mmt-85 -116.53 53.53 0.88 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.545 -0.909 . . . . 25.0 108.545 171.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.9 p -85.99 170.97 11.8 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.377 -1.712 . . . . 25.0 106.377 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 84.95 -168.3 42.98 Favored Glycine 0 C--N 1.321 -0.295 0 N-CA-C 116.157 1.223 . . . . 25.0 116.157 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.5 t -85.9 108.87 18.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 25.0 111.097 -168.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.425 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 50.0 p-80 -157.46 171.38 20.48 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.993 -0.548 . . . . 25.0 111.388 -176.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.42 151.04 7.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 107.963 -1.125 . . . . 25.0 107.963 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.4 mt -133.79 122.45 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 104.882 -2.266 . . . . 25.0 104.882 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.9 mp -106.54 133.39 51.3 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.71 -0.677 . . . . 25.0 109.921 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.24 135.32 53.33 Favored 'General case' 0 C--O 1.217 -0.631 0 C-N-CA 122.939 0.495 . . . . 25.0 110.227 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.96 145.87 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 122.13 0.967 . . . . 25.0 112.901 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -113.63 112.95 24.36 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.929 -1.878 . . . . 25.0 105.929 172.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.3 122.27 35.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.707 -1.22 . . . . 25.0 107.707 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 15.5 mm -79.14 141.72 14.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.153 -0.684 . . . . 25.0 109.153 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.32 -42.34 23.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.75 0.704 . . . . 25.0 109.845 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.88 -23.87 65.17 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.75 1.018 . . . . 25.0 113.75 -172.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 49.0 p -138.8 169.65 17.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.867 0.841 . . . . 25.0 110.149 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.92 19.01 0.91 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.308 -0.86 . . . . 25.0 112.356 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -90.05 146.17 24.53 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.26 0.837 . . . . 25.0 113.26 -175.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.65 143.19 11.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 105.291 -2.114 . . . . 25.0 105.291 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -148.06 128.35 13.87 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 111.632 0.234 . . . . 25.0 111.632 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -86.82 118.34 26.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.032 0.444 . . . . 25.0 110.679 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -96.99 115.44 27.43 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.258 -1.016 . . . . 25.0 108.258 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -85.7 142.38 29.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.131 -0.486 . . . . 25.0 111.921 -177.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -127.15 136.22 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 105.1 -2.185 . . . . 25.0 105.1 166.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -97.02 130.63 44.31 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.054 -1.461 . . . . 25.0 107.054 176.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -132.17 162.5 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 113.101 0.778 . . . . 25.0 113.101 -174.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.67 94.99 4.66 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 104.382 -2.451 . . . . 25.0 104.382 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.0 tp -90.54 163.76 14.48 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 112.747 0.647 . . . . 25.0 112.747 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.4 p -145.9 164.09 33.08 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.954 -1.128 . . . . 25.0 107.954 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.877 0 CA-C-O 117.74 -1.124 . . . . 25.0 111.536 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 121.086 0.469 . . . . 25.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.67 170.88 22.99 Favored Glycine 0 CA--C 1.509 -0.342 1 N-CA-C 101.652 -4.579 . . . . 25.0 101.652 -175.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -146.62 163.16 36.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 120.297 2.049 . . . . 25.0 110.687 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -97.86 121.87 48.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 106.743 -1.577 . . . . 25.0 106.743 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -75.61 -41.79 53.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.624 -1.171 . . . . 25.0 109.863 -174.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.64 129.3 5.17 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 106.018 -1.845 . . . . 25.0 106.018 176.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -64.46 132.25 13.62 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 128.751 0.73 . . . . 25.0 111.093 -0.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.78 112.61 4.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.038 -0.528 . . . . 25.0 111.855 -172.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.8 t -71.93 158.34 36.2 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 108.185 -1.043 . . . . 25.0 108.185 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -55.57 -24.77 34.49 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.304 0.642 . . . . 25.0 112.049 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.17 -53.78 33.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.819 0.819 . . . . 25.0 109.43 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -67.65 -35.09 78.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.505 -0.77 . . . . 25.0 110.564 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -63.68 -33.0 74.66 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.111 -0.368 . . . . 25.0 110.734 178.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -40.79 98.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.347 0.594 . . . . 25.0 109.555 177.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -67.85 -35.03 77.85 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.215 0.531 . . . . 25.0 110.185 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.69 5.47 9.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.034 -0.53 . . . . 25.0 111.436 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 59.1 24.95 13.32 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.097 1.359 . . . . 25.0 112.78 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 19' ' ' ASN . 89.1 mt -91.14 -21.84 20.98 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.131 -1.063 . . . . 25.0 108.131 174.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.464 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -124.06 159.9 28.88 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.011 -1.848 . . . . 25.0 106.011 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.2 p -134.73 175.49 9.5 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 122.261 0.225 . . . . 25.0 110.508 -176.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 70.21 5.08 5.15 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.574 1.694 . . . . 25.0 115.574 175.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.9 m -66.66 -38.49 86.95 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 121.412 -0.805 . . . . 25.0 110.565 172.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.63 -63.94 1.48 Allowed Glycine 0 C--O 1.218 -0.861 0 O-C-N 123.754 0.659 . . . . 25.0 112.114 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.3 t -88.06 -52.82 5.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.423 1.106 . . . . 25.0 111.098 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.64 -9.97 12.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.697 -1.138 . . . . 25.0 113.54 -171.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.97 -3.06 58.95 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.857 -0.527 . . . . 25.0 111.266 177.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -116.25 -34.02 4.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.456 -0.572 . . . . 25.0 109.456 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -126.9 97.67 32.24 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 109.989 -0.375 . . . . 25.0 109.989 173.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -74.97 -20.73 16.65 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 118.041 -0.839 . . . . 25.0 113.956 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -84.14 11.01 8.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.471 0.545 . . . . 25.0 112.471 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.7 m -64.83 -22.57 67.02 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.448 0.536 . . . . 25.0 112.448 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 9.1 m -64.04 121.42 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 115.12 1.526 . . . . 25.0 115.12 -173.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -152.82 158.54 42.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 106.517 -1.66 . . . . 25.0 106.517 174.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.47 -166.18 18.76 Favored Glycine 0 N--CA 1.453 -0.209 0 N-CA-C 108.094 -2.003 . . . . 25.0 108.094 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.0 tp -120.02 148.67 43.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.382 1.091 . . . . 25.0 112.079 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.39 157.0 33.0 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 171.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.25 2.02 1.64 Allowed Glycine 0 C--O 1.224 -0.493 0 CA-C-N 114.802 -1.09 . . . . 25.0 113.766 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -75.94 139.31 69.47 Favored Pre-proline 0 C--N 1.322 -0.622 0 O-C-N 121.576 -0.955 . . . . 25.0 110.067 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -93.45 -14.8 17.08 Favored 'Cis proline' 0 CA--C 1.544 0.981 0 C-N-CA 130.35 1.396 . . . . 25.0 115.613 -6.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -70.98 -35.82 72.27 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.936 1.458 . . . . 25.0 114.936 -168.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -121.39 31.63 6.24 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 105.553 -2.018 . . . . 25.0 105.553 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.48 -177.61 41.45 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 114.389 -1.278 . . . . 25.0 111.749 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.3 172.5 3.26 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 123.505 2.803 . . . . 25.0 113.498 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.05 160.01 31.03 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 107.141 -1.429 . . . . 25.0 107.141 173.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -61.21 139.13 58.19 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.249 -1.389 . . . . 25.0 107.249 175.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.06 86.37 Favored Glycine 0 C--O 1.228 -0.275 0 CA-C-N 116.079 -0.51 . . . . 25.0 112.593 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -125.58 9.58 7.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.906 -0.775 . . . . 25.0 108.906 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.7 mt -66.38 -49.51 74.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 122.132 -0.355 . . . . 25.0 111.631 -173.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.1 -25.39 59.77 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.637 -0.505 . . . . 25.0 109.637 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.4 p -79.85 -9.77 59.7 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.181 0.437 . . . . 25.0 112.181 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.37 34.4 14.93 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.857 0.863 . . . . 25.0 109.984 -172.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.23 39.26 25.95 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.951 1.463 . . . . 25.0 114.951 -177.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -120.16 134.63 55.21 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.992 0.517 . . . . 25.0 110.614 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.7 p -61.68 -35.76 78.9 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 115.368 1.618 . . . . 25.0 115.368 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.5 t -71.03 -7.18 44.6 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.308 0.575 . . . . 25.0 112.456 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.703 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.7 m-85 -121.74 13.47 10.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 107.607 -1.257 . . . . 25.0 107.607 -178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -72.14 -37.29 69.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.192 -0.942 . . . . 25.0 110.841 -175.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.7 mp0 -69.81 -17.02 63.38 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.85 0.833 . . . . 25.0 109.802 174.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.703 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.26 -5.47 59.32 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.902 -0.777 . . . . 25.0 108.902 -177.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.55 -32.82 6.34 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.561 0.578 . . . . 25.0 112.561 173.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -97.61 119.49 36.27 Favored 'General case' 0 CA--C 1.509 -0.609 0 O-C-N 121.458 -0.776 . . . . 25.0 110.629 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.475 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -123.92 160.95 26.39 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.383 -0.826 . . . . 25.0 109.596 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.2 p -117.29 162.48 27.91 Favored Pre-proline 0 C--N 1.317 -0.824 1 N-CA-C 99.908 -4.108 . . . . 25.0 99.908 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.33 -5.34 15.69 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 116.559 -1.828 . . . . 25.0 115.763 -174.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.25 10.38 9.29 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.177 0.513 . . . . 25.0 111.77 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -78.8 -28.77 44.62 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.042 0.756 . . . . 25.0 113.042 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.475 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.1 m95 -126.94 165.41 19.46 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 120.787 0.327 . . . . 25.0 110.463 -178.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.58 131.41 45.95 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 105.959 -1.867 . . . . 25.0 105.959 170.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -101.2 106.85 18.11 Favored 'General case' 0 CA--C 1.5 -0.964 0 N-CA-C 101.06 -3.681 . . . . 25.0 101.06 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.21 136.18 51.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.952 -1.022 . . . . 25.0 110.329 -177.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -90.23 104.04 16.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.802 -1.09 . . . . 25.0 108.478 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.3 mt -129.92 173.91 10.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.542 -1.281 . . . . 25.0 107.542 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.59 157.64 24.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.768 -0.651 . . . . 25.0 111.472 -174.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 69.6 p -77.04 169.52 18.18 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.154 -1.425 . . . . 25.0 107.154 172.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 91.2 -161.69 27.93 Favored Glycine 0 C--O 1.239 0.413 0 N-CA-C 110.702 -0.959 . . . . 25.0 110.702 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.88 132.2 46.28 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 119.012 1.406 . . . . 25.0 113.964 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -137.26 160.88 37.77 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.289 -1.745 . . . . 25.0 106.289 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.5 p -104.84 152.03 23.09 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.53 -1.285 . . . . 25.0 107.53 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -139.15 101.06 4.18 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 105.37 -2.085 . . . . 25.0 105.37 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.1 113.45 26.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.977 0.894 . . . . 25.0 109.924 -178.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.7 m95 -99.59 145.13 27.88 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.184 -0.917 . . . . 25.0 110.055 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -123.19 108.91 13.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 104.968 -2.234 . . . . 25.0 104.968 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -104.83 135.46 46.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.601 -0.727 . . . . 25.0 109.86 -173.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.7 t -101.28 17.67 21.96 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.723 0.773 . . . . 25.0 109.95 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.29 141.35 33.94 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.992 -0.744 . . . . 25.0 108.992 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -85.29 -4.85 59.3 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.662 0.615 . . . . 25.0 112.662 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.85 155.13 31.51 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.564 0.579 . . . . 25.0 112.564 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.3 t -74.39 155.83 37.68 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -173.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.446 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 9.8 t -99.09 157.94 16.0 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.013 -1.106 . . . . 25.0 108.013 173.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.6 t -117.75 -16.62 10.0 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.738 0.273 . . . . 25.0 111.738 172.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 t -171.91 152.44 2.99 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.869 0.366 . . . . 25.0 111.886 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -124.95 139.63 53.65 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.389 -2.449 . . . . 25.0 104.389 167.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -144.56 148.67 34.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.128 -1.064 . . . . 25.0 108.128 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.95 134.69 35.24 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 106.689 -1.597 . . . . 25.0 106.689 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -149.64 161.37 42.31 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.364 0.529 . . . . 25.0 110.187 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 163.15 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.52 0.933 . . . . 25.0 113.52 -167.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 p -77.46 161.15 28.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.811 -1.181 . . . . 25.0 107.811 171.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -61.44 157.24 47.28 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.044 -0.98 . . . . 25.0 109.16 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.89 -23.6 34.75 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 116.95 -1.566 . . . . 25.0 114.13 -172.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -113.36 32.01 6.07 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 122.621 0.368 . . . . 25.0 111.544 -174.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.483 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.0 p-90 -78.7 163.68 25.22 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.838 0.827 . . . . 25.0 111.587 -177.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -87.86 100.98 13.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.844 -1.071 . . . . 25.0 110.393 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -78.85 21.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 116.158 1.91 . . . . 25.0 116.158 -173.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -120.74 -0.78 10.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.37 0.605 . . . . 25.0 109.826 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -101.64 156.49 35.13 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.376 -0.829 . . . . 25.0 108.806 -176.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.39 158.27 57.84 Favored 'Trans proline' 0 C--N 1.346 0.437 0 O-C-N 121.882 0.411 . . . . 25.0 111.525 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.6 mp -71.99 97.61 1.91 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.324 0.583 . . . . 25.0 112.105 -176.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.7 p -91.87 152.94 19.85 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.474 -0.935 . . . . 25.0 108.474 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -65.26 -25.48 67.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.246 0.546 . . . . 25.0 111.049 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.87 -27.1 66.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.419 -0.81 . . . . 25.0 112.295 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 t -84.65 -5.87 59.33 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.054 0.391 . . . . 25.0 112.054 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -100.7 154.21 18.8 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 114.105 1.15 . . . . 25.0 114.105 -175.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -94.59 93.92 7.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 102.633 -3.099 . . . . 25.0 102.633 163.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.34 -7.3 23.6 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.735 1.383 . . . . 25.0 114.735 -169.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.8 t -83.68 128.31 64.18 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.285 -1.006 . . . . 25.0 108.285 176.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.71 146.51 48.79 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 115.278 -2.682 . . . . 25.0 111.336 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -97.11 -10.23 26.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.979 0.419 . . . . 25.0 111.527 -177.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.3 m -148.97 67.25 1.04 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.57 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -88.98 132.33 34.77 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 118.967 -1.093 . . . . 25.0 108.79 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -124.41 98.98 5.98 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 104.738 -2.319 . . . . 25.0 104.738 177.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -92.55 92.16 7.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.576 -1.268 . . . . 25.0 107.576 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -103.74 117.61 34.78 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 107.278 -1.379 . . . . 25.0 107.278 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -97.71 78.35 0.63 Allowed Glycine 0 CA--C 1.504 -0.636 0 CA-C-N 115.447 -0.797 . . . . 25.0 114.021 -169.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 112.3 22.0 6.01 Favored Glycine 0 C--N 1.321 -0.28 0 C-N-CA 120.817 -0.706 . . . . 25.0 113.203 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -73.68 107.03 5.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.531 0.681 . . . . 25.0 109.363 177.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.06 123.0 88.61 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 106.036 -1.838 . . . . 25.0 106.036 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.91 171.6 17.69 Favored 'Trans proline' 0 C--N 1.345 0.343 0 N-CA-C 113.715 0.621 . . . . 25.0 113.715 -175.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -100.11 27.27 5.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.581 -0.896 . . . . 25.0 108.581 176.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.56 -17.77 0.27 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.716 1.607 . . . . 25.0 112.365 -174.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 128' ' ' ALA . 67.5 mt-30 -127.23 153.33 46.24 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 103.494 -2.78 . . . . 25.0 103.494 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 69.5 t -141.41 95.08 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.604 0 N-CA-C 106.263 -1.754 . . . . 25.0 106.263 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.5 t -85.96 143.79 27.98 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 103.557 -2.757 . . . . 25.0 103.557 172.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.04 167.0 29.86 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.933 -1.485 . . . . 25.0 107.59 -177.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -134.67 156.05 49.44 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 106.654 -1.61 . . . . 25.0 106.654 174.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.6 160.34 25.71 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.098 -1.445 . . . . 25.0 107.098 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -104.75 116.96 32.91 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.054 0.222 . . . . 25.0 110.979 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.86 132.12 68.66 Favored Pre-proline 0 CA--C 1.54 0.576 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -61.96 147.94 94.14 Favored 'Trans proline' 0 C--N 1.352 0.716 0 CA-C-O 121.652 0.605 . . . . 25.0 113.474 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.57 -26.54 34.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.32 -0.855 . . . . 25.0 112.594 -169.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -83.6 10.1 9.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.602 0.715 . . . . 25.0 110.305 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.3 mmt-85 -116.34 50.0 1.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.568 -0.901 . . . . 25.0 108.568 172.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 35.9 p -86.0 164.94 17.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.672 -1.603 . . . . 25.0 106.672 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 91.97 -167.94 31.0 Favored Glycine 0 N--CA 1.451 -0.339 0 N-CA-C 115.043 0.777 . . . . 25.0 115.043 177.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -85.99 111.03 19.89 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.369 0.604 . . . . 25.0 110.908 -168.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.427 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 48.5 p-80 -159.14 171.08 20.59 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 115.913 -0.585 . . . . 25.0 111.241 -176.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.0 p -104.75 150.5 7.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 N-CA-C 107.834 -1.173 . . . . 25.0 107.834 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 53.6 mt -132.24 120.99 45.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 -179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.0 mp -104.83 131.53 52.19 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.394 -0.821 . . . . 25.0 109.62 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -123.59 133.14 54.0 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.519 -0.549 . . . . 25.0 109.519 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.46 143.78 36.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 122.073 0.939 . . . . 25.0 112.356 -178.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.446 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.8 t90 -113.8 113.22 24.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.872 -1.899 . . . . 25.0 105.872 173.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.64 125.74 38.41 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.981 -1.118 . . . . 25.0 107.981 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 17.6 mm -80.71 142.1 14.33 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.901 -0.777 . . . . 25.0 108.901 -179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.53 -43.49 22.99 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 118.806 0.73 . . . . 25.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.2 -23.24 64.81 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.749 1.018 . . . . 25.0 113.749 -172.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.1 p -138.63 168.76 19.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.962 0.887 . . . . 25.0 110.022 -175.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.88 21.31 0.69 Allowed 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.216 -0.902 . . . . 25.0 112.313 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -91.63 145.27 24.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.076 0.769 . . . . 25.0 113.076 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -160.55 143.58 13.29 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 105.106 -2.183 . . . . 25.0 105.106 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -148.55 129.77 14.62 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.137 0.421 . . . . 25.0 112.137 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -85.53 117.37 24.39 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 121.105 0.479 . . . . 25.0 111.063 177.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -97.12 108.19 20.87 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.318 -1.364 . . . . 25.0 107.318 177.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.16 142.76 30.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.598 -0.728 . . . . 25.0 111.829 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -126.9 136.1 61.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 105.424 -2.065 . . . . 25.0 105.424 168.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -97.02 129.11 44.52 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 176.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.51 163.07 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 113.157 0.799 . . . . 25.0 113.157 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -117.83 95.28 4.85 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 103.994 -2.595 . . . . 25.0 103.994 166.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.6 tp -89.94 163.04 15.12 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 120.909 0.385 . . . . 25.0 111.652 -172.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.0 p -145.85 158.03 43.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.567 -0.901 . . . . 25.0 108.567 175.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 118.113 -0.946 . . . . 25.0 111.368 -178.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 37.0 m170 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 110.599 -0.149 . . . . 25.0 110.599 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 146.23 166.09 11.89 Favored Glycine 0 N--CA 1.459 0.217 1 N-CA-C 102.758 -4.137 . . . . 25.0 102.758 -174.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.2 p90 -149.38 168.12 24.27 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.444 2.122 . . . . 25.0 111.921 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -103.82 124.37 58.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.565 -1.272 . . . . 25.0 107.565 176.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -77.89 -43.18 30.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.922 -1.036 . . . . 25.0 109.968 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -152.89 129.8 5.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.923 -1.88 . . . . 25.0 105.923 176.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.76 130.79 9.84 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.933 0.806 . . . . 25.0 111.451 0.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.43 112.76 4.81 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.875 -0.602 . . . . 25.0 112.11 -172.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.7 t -72.14 157.34 37.93 Favored 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 108.667 -0.864 . . . . 25.0 108.667 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -55.2 -25.61 33.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.726 0.81 . . . . 25.0 111.924 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.26 30.21 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.824 0.821 . . . . 25.0 109.157 175.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -66.48 -35.74 81.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.407 -0.815 . . . . 25.0 110.498 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -63.3 -33.36 75.35 Favored 'General case' 0 C--O 1.22 -0.491 0 O-C-N 122.157 -0.34 . . . . 25.0 110.849 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -39.79 94.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.225 0.536 . . . . 25.0 109.862 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.2 tmtm? -68.21 -35.19 77.59 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.226 0.536 . . . . 25.0 110.034 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -77.77 4.4 11.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.139 -0.482 . . . . 25.0 111.278 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 58.95 22.39 10.29 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.175 1.39 . . . . 25.0 112.975 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.457 ' C ' HD22 ' A' ' 19' ' ' ASN . 92.8 mt -86.55 -21.69 26.76 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 174.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.457 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.4 m120 -123.75 158.81 30.84 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 105.435 -2.061 . . . . 25.0 105.435 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.3 p -135.81 176.95 8.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.439 -0.578 . . . . 25.0 109.439 -176.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 71.3 5.13 5.33 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 115.442 1.645 . . . . 25.0 115.442 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -68.76 -38.13 79.87 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 121.53 -0.732 . . . . 25.0 110.821 174.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.8 -63.62 1.55 Allowed Glycine 0 C--O 1.217 -0.924 0 O-C-N 123.713 0.633 . . . . 25.0 112.116 -178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.8 t -88.0 -53.31 4.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 122.503 1.144 . . . . 25.0 111.643 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.9 OUTLIER -68.28 -11.11 13.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.563 -1.199 . . . . 25.0 113.239 -171.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -86.91 -2.71 58.81 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.751 -0.593 . . . . 25.0 111.479 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -116.25 -34.11 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.129 -0.628 . . . . 25.0 109.594 173.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -126.9 92.44 44.55 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-O 120.926 0.393 . . . . 25.0 111.463 171.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.401 ' HA ' HG12 ' A' ' 25' ' ' VAL . 85.6 Cg_endo -74.15 -19.13 20.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 117.66 -1.093 . . . . 25.0 114.022 -176.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -87.99 5.38 41.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.231 0.456 . . . . 25.0 112.231 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -2.28 24.33 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.993 0.738 . . . . 25.0 112.993 178.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 22.3 m -64.08 138.03 23.76 Favored 'Isoleucine or valine' 0 C--O 1.247 0.924 0 N-CA-C 113.343 0.868 . . . . 25.0 113.343 -177.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -153.02 152.28 31.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.345 -0.843 . . . . 25.0 108.779 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.58 -176.35 33.58 Favored Glycine 0 N--CA 1.452 -0.256 0 N-CA-C 107.346 -2.302 . . . . 25.0 107.346 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.84 150.3 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 118.364 1.082 . . . . 25.0 111.758 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -65.52 156.98 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.602 -1.258 . . . . 25.0 107.602 172.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.82 -1.74 3.57 Favored Glycine 0 C--O 1.224 -0.504 0 CA-C-N 114.756 -1.111 . . . . 25.0 112.797 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -75.98 142.1 72.22 Favored Pre-proline 0 C--N 1.322 -0.617 0 O-C-N 121.546 -0.973 . . . . 25.0 109.374 -177.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -91.89 -13.74 23.15 Favored 'Cis proline' 0 CA--C 1.541 0.87 0 C-N-CA 130.065 1.277 . . . . 25.0 115.227 -6.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -70.71 -37.81 73.57 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.782 1.401 . . . . 25.0 114.782 -169.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.79 34.95 5.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 106.118 -1.808 . . . . 25.0 106.118 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.45 -174.41 46.06 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 114.613 -1.176 . . . . 25.0 111.311 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -59.8 173.71 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 124.257 3.305 . . . . 25.0 113.049 176.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.95 159.92 31.22 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.915 -1.513 . . . . 25.0 106.915 173.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -61.03 139.36 58.08 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 107.138 -1.43 . . . . 25.0 107.138 175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.24 -5.05 81.98 Favored Glycine 0 C--O 1.228 -0.224 0 CA-C-N 116.06 -0.518 . . . . 25.0 112.826 -174.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -124.2 10.88 8.74 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.26 -0.644 . . . . 25.0 109.26 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.63 -49.96 74.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 122.272 -0.267 . . . . 25.0 111.291 -174.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.39 -24.66 59.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.709 -0.478 . . . . 25.0 109.709 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 p -80.45 -9.74 59.75 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.269 0.47 . . . . 25.0 112.269 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.28 34.43 14.73 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.689 0.795 . . . . 25.0 110.267 -172.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.55 41.16 26.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.467 1.284 . . . . 25.0 114.467 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.0 mmtm -121.31 136.26 54.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.345 0.658 . . . . 25.0 110.529 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -63.5 -35.26 79.89 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 114.696 1.369 . . . . 25.0 114.696 -175.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 t -72.03 -7.12 47.01 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.621 0.6 . . . . 25.0 112.621 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.689 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.4 m-85 -120.13 13.58 12.1 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 107.14 -1.43 . . . . 25.0 107.14 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -72.54 -35.71 68.1 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.998 -1.064 . . . . 25.0 110.604 -175.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 -69.26 -17.37 63.74 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.923 0.868 . . . . 25.0 109.646 174.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.689 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.5 mp -86.44 -5.36 59.18 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.485 -0.78 . . . . 25.0 109.007 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -113.97 -32.6 6.01 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.284 0.476 . . . . 25.0 112.284 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -91.65 115.89 28.42 Favored 'General case' 0 CA--C 1.509 -0.606 0 O-C-N 121.583 -0.698 . . . . 25.0 110.34 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.2 pm0 -125.17 161.02 27.79 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.149 -0.686 . . . . 25.0 109.149 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -116.55 163.96 20.2 Favored Pre-proline 0 C--N 1.317 -0.827 0 N-CA-C 100.348 -3.945 . . . . 25.0 100.348 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.88 -4.04 12.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 116.74 -1.707 . . . . 25.0 115.86 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -127.98 12.52 6.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.355 0.598 . . . . 25.0 111.506 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -76.6 -28.8 56.28 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.283 0.846 . . . . 25.0 113.283 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 13.4 m95 -126.14 167.12 15.83 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 120.598 0.237 . . . . 25.0 110.557 -178.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -66.68 119.86 12.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.815 -1.921 . . . . 25.0 105.815 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -94.0 103.5 15.58 Favored 'General case' 0 CA--C 1.5 -0.975 1 N-CA-C 100.094 -4.039 . . . . 25.0 100.094 177.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.31 135.05 54.87 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.926 -1.034 . . . . 25.0 110.312 -176.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -90.4 101.09 13.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.648 -1.16 . . . . 25.0 108.296 -177.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -129.38 173.89 10.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 107.673 -1.232 . . . . 25.0 107.673 -176.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.25 155.36 25.21 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 25.0 111.709 -174.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.414 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.9 p -76.99 167.99 20.87 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 106.836 -1.542 . . . . 25.0 106.836 172.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 93.1 -160.89 25.18 Favored Glycine 0 C--O 1.24 0.487 0 N-CA-C 110.609 -0.997 . . . . 25.0 110.609 -178.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -58.99 133.62 54.67 Favored 'Trans proline' 0 C--N 1.346 0.446 0 CA-C-N 119.019 1.41 . . . . 25.0 113.931 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -138.79 160.74 38.94 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 106.797 -1.557 . . . . 25.0 106.797 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 43.0 p -103.1 151.12 22.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.329 -1.359 . . . . 25.0 107.329 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -138.57 101.04 4.25 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 105.455 -2.054 . . . . 25.0 105.455 -177.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.61 116.45 32.09 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.949 0.88 . . . . 25.0 109.132 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -104.07 150.37 24.35 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.218 -0.901 . . . . 25.0 109.794 178.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -127.79 111.67 13.91 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 105.079 -2.193 . . . . 25.0 105.079 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.0 mp -109.22 122.36 47.16 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.633 -0.712 . . . . 25.0 111.71 -173.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -87.5 17.69 4.39 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.479 0.657 . . . . 25.0 111.227 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -141.33 140.37 33.77 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 121.615 -0.678 . . . . 25.0 110.133 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -82.55 -8.55 59.6 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.852 -0.613 . . . . 25.0 112.025 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -63.8 156.18 28.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.236 0.458 . . . . 25.0 112.236 -175.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.6 t -83.36 155.99 23.25 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 114.239 1.2 . . . . 25.0 114.239 -171.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.5 t -99.65 157.22 16.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.876 -0.602 . . . . 25.0 109.469 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.2 t -117.94 -14.22 10.03 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.559 0.207 . . . . 25.0 111.559 172.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.1 t -172.61 150.31 2.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.807 0.337 . . . . 25.0 111.824 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -122.86 139.5 53.95 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 104.521 -2.4 . . . . 25.0 104.521 166.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -144.75 151.83 39.45 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.454 -1.313 . . . . 25.0 107.454 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -137.94 134.39 34.89 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.75 -1.945 . . . . 25.0 105.75 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.46 164.01 34.72 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.345 0.52 . . . . 25.0 109.881 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.92 164.28 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 113.481 0.919 . . . . 25.0 113.481 -167.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.4 p -78.65 162.36 26.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -62.07 157.77 49.78 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.264 -0.88 . . . . 25.0 109.065 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.33 -25.34 36.31 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 116.534 -1.844 . . . . 25.0 114.036 -173.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -113.0 31.99 6.03 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.694 0.397 . . . . 25.0 110.882 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.487 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -73.67 165.02 25.87 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.031 0.919 . . . . 25.0 112.982 -175.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -83.1 100.93 10.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.496 -1.229 . . . . 25.0 109.857 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.487 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -88.14 12.2 14.28 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 116.693 2.109 . . . . 25.0 116.693 -169.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 12.4 t -119.23 6.45 11.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 176.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -109.71 156.62 39.44 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.666 -1.152 . . . . 25.0 108.042 -174.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.53 156.85 64.39 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 O-C-N 121.942 0.443 . . . . 25.0 111.847 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.05 105.17 3.24 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.28 0.562 . . . . 25.0 112.075 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.0 p -98.64 154.82 17.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.772 -0.825 . . . . 25.0 108.772 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -65.0 -26.05 68.12 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.913 -0.492 . . . . 25.0 111.484 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.84 -26.95 65.41 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.702 -0.681 . . . . 25.0 112.112 176.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 35.3 t -83.34 -5.39 59.13 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 112.135 0.42 . . . . 25.0 112.135 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -101.96 153.7 19.63 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.688 1.366 . . . . 25.0 114.688 -175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -94.86 95.42 8.66 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 102.556 -3.128 . . . . 25.0 102.556 163.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.1 mt -67.06 -6.81 18.79 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -169.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.1 t -86.95 131.28 45.42 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 108.951 -0.759 . . . . 25.0 108.951 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -72.64 149.63 49.36 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 115.54 -2.506 . . . . 25.0 111.446 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -99.62 -12.07 20.39 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.151 0.426 . . . . 25.0 112.151 -177.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.7 m -147.47 65.86 1.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.366 -0.379 . . . . 25.0 110.357 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -88.99 135.87 33.32 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 118.458 -1.297 . . . . 25.0 109.176 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -123.19 99.13 6.2 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 103.406 -2.813 . . . . 25.0 103.406 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -91.83 92.06 8.2 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 106.535 -1.654 . . . . 25.0 106.535 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -109.91 119.32 38.97 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 107.984 -1.117 . . . . 25.0 107.984 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -95.64 77.94 0.82 Allowed Glycine 0 CA--C 1.503 -0.713 0 CA-C-N 115.33 -0.85 . . . . 25.0 113.844 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 108.98 23.56 6.39 Favored Glycine 0 C--N 1.32 -0.306 0 C-N-CA 120.899 -0.667 . . . . 25.0 114.08 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -72.06 105.89 4.1 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.792 0.806 . . . . 25.0 110.005 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 87.7 mt -69.97 127.06 92.67 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 106.596 -1.631 . . . . 25.0 106.596 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.17 169.73 21.91 Favored 'Trans proline' 0 C--N 1.345 0.376 0 N-CA-C 113.998 0.73 . . . . 25.0 113.998 -176.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.417 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -102.89 30.86 4.49 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.784 -1.191 . . . . 25.0 107.784 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.61 -21.02 0.22 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.997 1.719 . . . . 25.0 111.969 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.417 ' H ' ' C ' ' A' ' 128' ' ' ALA . 62.7 mt-30 -126.64 156.56 40.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 104.219 -2.512 . . . . 25.0 104.219 169.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.0 t -138.96 95.07 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.134 -2.173 . . . . 25.0 105.134 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 8.7 t -87.84 139.98 29.97 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.936 -2.616 . . . . 25.0 103.936 174.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -152.62 166.93 30.55 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 113.883 -1.508 . . . . 25.0 108.779 -175.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -135.44 155.89 49.8 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.058 -1.83 . . . . 25.0 106.058 174.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.06 161.32 25.27 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.019 -1.474 . . . . 25.0 107.019 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -105.89 118.65 37.15 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.992 0.182 . . . . 25.0 110.868 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -80.2 131.9 61.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -61.99 147.2 95.62 Favored 'Trans proline' 0 C--N 1.353 0.784 0 CA-C-O 121.615 0.59 . . . . 25.0 113.456 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.414 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.75 -25.69 35.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 25.0 112.526 -169.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -83.58 9.74 10.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.684 0.754 . . . . 25.0 110.192 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.0 mmt-85 -115.99 52.97 0.88 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.375 -0.972 . . . . 25.0 108.375 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.4 p -86.0 166.92 15.51 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.983 -1.488 . . . . 25.0 106.983 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.74 -166.76 34.43 Favored Glycine 0 C--O 1.238 0.389 0 N-CA-C 115.926 1.131 . . . . 25.0 115.926 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.0 t -86.01 107.6 17.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.436 0.636 . . . . 25.0 110.813 -168.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -157.93 171.27 20.56 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.774 -0.648 . . . . 25.0 110.871 -176.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.57 149.98 7.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.64 -1.245 . . . . 25.0 107.64 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 57.0 mt -132.99 127.71 55.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 101.665 -3.458 . . . . 25.0 101.665 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.92 132.0 56.81 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.711 -0.477 . . . . 25.0 109.711 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -110.92 128.69 55.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.437 -0.949 . . . . 25.0 108.437 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.6 p -122.29 137.93 54.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.991 0.9 . . . . 25.0 111.014 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 12.4 t90 -115.71 116.19 27.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.783 -1.553 . . . . 25.0 107.008 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.3 126.91 40.93 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.959 -1.126 . . . . 25.0 107.959 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 18.8 mm -82.6 140.96 15.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.09 -0.707 . . . . 25.0 109.09 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -78.19 -43.07 29.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.824 0.738 . . . . 25.0 110.014 176.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.36 -23.59 64.7 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 114.092 1.145 . . . . 25.0 114.092 -172.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.4 p -138.78 169.76 17.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.993 0.901 . . . . 25.0 110.118 -174.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.28 19.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.142 -0.935 . . . . 25.0 112.491 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -90.04 146.99 23.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.852 0.686 . . . . 25.0 112.852 -176.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -158.03 141.74 15.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 104.576 -2.379 . . . . 25.0 104.576 170.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -146.39 134.79 21.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.262 0.467 . . . . 25.0 112.262 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -91.56 115.1 27.77 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.918 0.762 . . . . 25.0 110.808 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -97.05 108.1 20.76 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 107.446 -1.316 . . . . 25.0 107.446 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -83.38 139.99 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.377 -0.829 . . . . 25.0 111.757 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 3.7 tt -125.54 132.86 70.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 105.311 -2.107 . . . . 25.0 105.311 167.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -94.02 130.41 40.16 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.981 -1.489 . . . . 25.0 106.981 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.4 m -131.81 161.35 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.912 0.708 . . . . 25.0 112.912 -175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -117.71 95.0 4.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 103.654 -2.721 . . . . 25.0 103.654 166.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.4 HD23 HG22 ' A' ' 74' ' ' THR . 2.8 tp -89.93 161.27 16.0 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.086 0.47 . . . . 25.0 111.825 -171.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 77.2 p -145.86 164.29 32.41 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.815 -0.809 . . . . 25.0 108.815 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.707 0 CA-C-O 118.041 -0.98 . . . . 25.0 110.378 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.9 m80 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.246 0.546 . . . . 25.0 110.372 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.41 177.53 35.51 Favored Glycine 0 CA--C 1.508 -0.348 1 N-CA-C 101.717 -4.553 . . . . 25.0 101.717 -176.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -148.16 165.82 29.74 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 120.019 1.91 . . . . 25.0 109.414 177.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -100.59 122.43 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 106.481 -1.674 . . . . 25.0 106.481 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -75.24 -43.21 52.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.708 -1.133 . . . . 25.0 109.859 -173.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.8 t -153.69 129.76 5.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.194 -1.78 . . . . 25.0 106.194 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.43 130.83 10.69 Favored 'Cis proline' 0 CA--C 1.534 0.479 0 C-N-CA 128.89 0.788 . . . . 25.0 111.386 -0.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.21 113.4 5.12 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.985 -0.552 . . . . 25.0 112.334 -172.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -72.1 158.23 36.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.038 -0.727 . . . . 25.0 109.038 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -55.32 -25.23 33.35 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.387 0.675 . . . . 25.0 112.02 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.51 -53.35 36.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.782 0.801 . . . . 25.0 109.455 176.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -67.61 -35.7 79.44 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.456 -0.793 . . . . 25.0 110.301 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -63.6 -33.18 75.04 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 120.97 -0.292 . . . . 25.0 110.759 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.82 -40.31 96.32 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.257 0.551 . . . . 25.0 110.092 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.3 tmtm? -68.14 -35.4 78.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.28 0.562 . . . . 25.0 110.071 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.88 4.43 9.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.098 -0.501 . . . . 25.0 111.518 176.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 58.75 23.69 11.43 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.22 1.408 . . . . 25.0 112.851 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.448 ' C ' HD22 ' A' ' 19' ' ' ASN . 87.8 mt -87.89 -22.43 24.4 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.611 -1.255 . . . . 25.0 107.611 174.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.448 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.62 159.34 29.48 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 105.316 -2.105 . . . . 25.0 105.316 177.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.4 p -135.36 175.23 9.78 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.352 -0.24 . . . . 25.0 110.352 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 70.32 5.4 5.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.783 1.771 . . . . 25.0 115.783 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.47 -34.44 77.94 Favored 'General case' 0 CA--C 1.497 -1.059 0 O-C-N 121.375 -0.828 . . . . 25.0 110.359 172.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.36 -64.14 1.38 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.9 0.75 . . . . 25.0 112.153 179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.9 t -87.98 -53.41 4.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 122.539 1.162 . . . . 25.0 111.633 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.18 -10.73 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 114.523 -1.217 . . . . 25.0 113.233 -171.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -85.5 -3.53 58.89 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.917 -0.489 . . . . 25.0 111.13 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -115.66 -34.09 4.97 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.407 -0.517 . . . . 25.0 110.005 173.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -126.94 98.81 29.94 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 120.672 0.273 . . . . 25.0 110.798 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 88.0 Cg_endo -76.92 -20.77 12.92 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 117.619 -1.121 . . . . 25.0 114.312 -174.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -82.27 9.06 9.56 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.211 0.449 . . . . 25.0 112.211 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.6 m -64.94 -23.2 67.15 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.15 0.796 . . . . 25.0 113.15 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.0 m -64.06 122.95 15.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 115.226 1.565 . . . . 25.0 115.226 -172.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.93 159.1 42.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 105.778 -1.934 . . . . 25.0 105.778 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.15 -168.58 23.23 Favored Glycine 0 N--CA 1.454 -0.156 0 N-CA-C 108.879 -1.689 . . . . 25.0 108.879 -177.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.4 tp -115.11 147.36 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.241 1.021 . . . . 25.0 112.062 -177.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -65.56 157.03 30.84 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 109.033 -0.729 . . . . 25.0 109.033 171.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 138.57 0.14 2.38 Favored Glycine 0 C--O 1.222 -0.646 0 CA-C-N 114.504 -1.225 . . . . 25.0 113.732 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -75.87 138.36 69.57 Favored Pre-proline 0 C--N 1.322 -0.628 0 O-C-N 121.402 -1.057 . . . . 25.0 110.815 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -92.77 -14.73 18.69 Favored 'Cis proline' 0 CA--C 1.544 0.98 0 C-N-CA 130.259 1.358 . . . . 25.0 115.385 -7.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -69.38 -35.62 76.0 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 115.162 1.541 . . . . 25.0 115.162 -168.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.97 34.1 4.94 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 105.846 -1.909 . . . . 25.0 105.846 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.78 -170.75 40.36 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.489 -1.232 . . . . 25.0 111.748 -176.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -60.5 170.39 4.34 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.994 2.462 . . . . 25.0 113.104 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 159.84 31.2 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 106.729 -1.582 . . . . 25.0 106.729 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -61.75 140.26 58.23 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.644 -1.243 . . . . 25.0 107.644 176.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.27 -4.43 85.6 Favored Glycine 0 N--CA 1.453 -0.206 0 CA-C-N 115.782 -0.645 . . . . 25.0 112.373 -174.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -125.85 12.75 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.954 -0.387 . . . . 25.0 109.954 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.45 -52.87 46.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.122 -0.361 . . . . 25.0 111.824 -173.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.15 -20.04 59.57 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.889 -0.507 . . . . 25.0 109.969 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 p -83.24 -9.43 59.14 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.889 -0.325 . . . . 25.0 111.826 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.07 34.21 13.62 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.822 0.849 . . . . 25.0 110.342 -172.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 59.07 37.33 24.29 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.666 1.358 . . . . 25.0 114.666 -177.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -120.95 134.7 55.3 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.039 0.536 . . . . 25.0 110.891 175.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 p -62.27 -33.88 75.48 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 115.19 1.552 . . . . 25.0 115.19 -174.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 t -70.67 -8.22 50.33 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.145 0.498 . . . . 25.0 112.296 -178.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.721 ' HA ' HD13 ' A' ' 59' ' ' LEU . 12.9 m-85 -120.5 15.83 12.06 Favored 'General case' 0 C--O 1.215 -0.745 0 N-CA-C 107.544 -1.28 . . . . 25.0 107.544 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -70.4 -40.48 73.87 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.146 -0.971 . . . . 25.0 111.739 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.59 -15.35 63.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.91 0.862 . . . . 25.0 109.942 175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.721 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -85.65 -6.55 59.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.73 -0.841 . . . . 25.0 108.73 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -112.28 -33.73 6.12 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.236 0.828 . . . . 25.0 113.236 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -96.21 119.41 34.64 Favored 'General case' 0 CA--C 1.509 -0.604 0 O-C-N 121.424 -0.798 . . . . 25.0 110.907 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -125.94 161.03 28.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.971 -1.013 . . . . 25.0 109.919 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 53.8 p -116.13 160.66 34.73 Favored Pre-proline 0 C--N 1.319 -0.747 1 N-CA-C 99.857 -4.127 . . . . 25.0 99.857 160.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -70.37 -0.49 7.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 116.995 -1.537 . . . . 25.0 115.794 -174.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.1 t -123.93 10.02 8.83 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.108 0.48 . . . . 25.0 111.471 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -78.49 -29.28 46.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.888 0.699 . . . . 25.0 112.888 -176.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.496 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 5.6 m95 -126.65 165.55 19.0 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.856 -0.424 . . . . 25.0 109.856 -179.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -67.22 131.4 45.7 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.408 -1.701 . . . . 25.0 106.408 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -100.03 105.45 17.12 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 101.325 -3.583 . . . . 25.0 101.325 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.7 136.25 52.6 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.929 -1.032 . . . . 25.0 111.057 -177.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -87.79 106.75 18.28 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.948 -1.024 . . . . 25.0 109.051 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 92.1 mt -132.38 173.73 10.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.485 -1.302 . . . . 25.0 107.485 -179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 157.94 23.32 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.768 -0.651 . . . . 25.0 110.843 -174.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.448 HG21 ' HA ' ' A' ' 139' ' ' ALA . 64.8 p -77.06 169.8 17.67 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 107.099 -1.445 . . . . 25.0 107.099 172.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 89.82 -160.35 28.67 Favored Glycine 0 C--O 1.239 0.439 0 N-CA-C 110.602 -0.999 . . . . 25.0 110.602 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.27 132.32 45.99 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 119.087 1.443 . . . . 25.0 114.218 -177.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -137.88 161.43 36.65 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.281 -1.748 . . . . 25.0 106.281 178.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 p -104.35 151.15 23.81 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.616 -1.254 . . . . 25.0 107.616 178.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -139.31 100.95 4.13 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 105.775 -1.935 . . . . 25.0 105.775 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.83 115.04 29.82 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 122.169 0.985 . . . . 25.0 109.483 -179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 55.7 m95 -101.17 148.43 25.1 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 114.964 -1.016 . . . . 25.0 109.701 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -126.9 111.1 13.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.215 -2.143 . . . . 25.0 105.215 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.73 128.49 56.44 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.619 0.768 . . . . 25.0 111.73 -173.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.91 -32.61 23.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.315 0.579 . . . . 25.0 109.623 174.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.4 122.01 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.842 0.353 . . . . 25.0 110.54 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 -82.59 3.33 29.15 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.728 1.01 . . . . 25.0 113.728 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.78 152.98 44.47 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.653 -0.419 . . . . 25.0 109.997 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -68.99 156.0 39.36 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 114.308 1.225 . . . . 25.0 114.308 -171.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.408 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 13.4 t -96.88 159.78 14.73 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.181 -1.044 . . . . 25.0 108.181 173.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.9 t -117.86 -16.13 9.97 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 123.143 0.277 . . . . 25.0 110.442 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.53 160.2 4.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.207 0.527 . . . . 25.0 112.224 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 49.1 m95 -128.48 134.93 48.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.071 -2.566 . . . . 25.0 104.071 168.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -140.34 150.05 43.48 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.873 -0.788 . . . . 25.0 108.873 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -137.94 138.14 38.67 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.641 -1.614 . . . . 25.0 106.641 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -149.62 161.57 41.9 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.545 0.611 . . . . 25.0 110.305 176.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.96 163.29 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 114.014 1.116 . . . . 25.0 114.014 -169.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 21.9 p -77.73 164.19 25.48 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.238 -1.023 . . . . 25.0 108.238 171.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -64.3 159.75 55.65 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 107.838 -1.171 . . . . 25.0 107.838 176.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -68.57 -26.37 33.9 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 115.921 -2.253 . . . . 25.0 113.983 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -114.08 32.01 6.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.881 0.473 . . . . 25.0 111.037 -176.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.471 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -68.39 168.85 11.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.05 0.929 . . . . 25.0 112.91 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -83.17 100.97 10.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.602 -1.181 . . . . 25.0 109.461 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.471 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -92.86 8.9 37.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.895 1.813 . . . . 25.0 115.895 -169.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.4 t -125.62 13.69 8.09 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.644 -0.872 . . . . 25.0 108.644 177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -116.94 158.61 43.57 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 114.281 -1.327 . . . . 25.0 107.677 -174.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -65.69 152.7 80.93 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 118.22 -0.72 . . . . 25.0 111.248 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.2 mp -69.53 101.97 1.72 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.786 0.661 . . . . 25.0 112.786 -175.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.3 p -95.44 153.75 17.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.876 -1.157 . . . . 25.0 107.876 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -64.13 -24.51 67.72 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.065 0.459 . . . . 25.0 111.559 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.4 -26.79 67.41 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 25.0 112.415 177.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -80.59 -6.57 58.48 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.598 0.592 . . . . 25.0 112.598 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 50.5 m-85 -105.41 157.51 17.3 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 115.428 1.64 . . . . 25.0 115.428 -175.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.14 96.25 7.98 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 102.606 -3.109 . . . . 25.0 102.606 162.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.4 mt -67.98 -6.82 24.24 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.938 1.459 . . . . 25.0 114.938 -169.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.4 t -79.88 133.47 58.34 Favored Pre-proline 0 C--N 1.321 -0.635 0 N-CA-C 108.995 -0.742 . . . . 25.0 108.995 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -72.37 148.38 48.73 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 114.824 -2.984 . . . . 25.0 110.596 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -102.67 -8.32 21.01 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.032 0.444 . . . . 25.0 111.277 -179.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.23 68.86 1.04 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.962 -0.563 . . . . 25.0 109.894 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -88.93 129.39 35.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 119.488 -0.885 . . . . 25.0 108.931 177.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -121.45 98.98 6.22 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 104.272 -2.492 . . . . 25.0 104.272 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -90.99 92.01 8.57 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.014 -1.106 . . . . 25.0 108.014 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -110.77 117.42 33.4 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 106.994 -1.484 . . . . 25.0 106.994 175.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.18 82.72 0.35 Allowed Glycine 0 CA--C 1.501 -0.819 0 CA-C-N 115.409 -0.814 . . . . 25.0 112.717 -170.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 122.64 13.19 4.74 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 120.98 -0.628 . . . . 25.0 113.812 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.28 104.04 5.69 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.271 -0.64 . . . . 25.0 109.271 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 84.7 mt -74.76 122.83 88.35 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.142 -1.429 . . . . 25.0 107.142 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -73.51 156.8 49.61 Favored 'Trans proline' 0 C--N 1.345 0.389 0 N-CA-C 114.503 0.924 . . . . 25.0 114.503 -176.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -99.14 29.39 3.92 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.028 -1.101 . . . . 25.0 108.028 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 73.56 -15.89 0.53 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.881 1.673 . . . . 25.0 112.601 -176.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -130.55 148.97 52.41 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 170.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.5 t -142.48 94.96 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 106.996 -1.483 . . . . 25.0 106.996 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.1 t -88.71 136.89 32.77 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 105.536 -2.024 . . . . 25.0 105.536 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -142.9 166.94 23.27 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 106.12 -1.807 . . . . 25.0 106.12 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -133.46 152.87 51.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 105.415 -2.069 . . . . 25.0 105.415 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -159.65 159.54 33.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.795 -1.187 . . . . 25.0 107.795 -178.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -105.29 115.52 30.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.737 0.273 . . . . 25.0 111.737 -175.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -78.79 132.6 64.03 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 108.753 -0.832 . . . . 25.0 108.753 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -61.66 146.81 96.51 Favored 'Trans proline' 0 C--N 1.354 0.864 0 N-CA-C 113.682 0.609 . . . . 25.0 113.682 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.448 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -79.57 -29.56 41.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.299 -0.864 . . . . 25.0 112.98 -168.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.7 p-10 -81.88 7.07 13.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.584 -0.735 . . . . 25.0 110.594 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 85.1 mmt-85 -114.03 51.9 0.85 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.027 -1.101 . . . . 25.0 108.027 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.09 170.96 11.73 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.557 -1.645 . . . . 25.0 106.557 175.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 86.89 -167.37 38.17 Favored Glycine 0 C--N 1.321 -0.263 0 N-CA-C 116.213 1.245 . . . . 25.0 116.213 176.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 35.4 t -86.03 106.91 17.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.41 0.624 . . . . 25.0 110.985 -168.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -158.2 171.25 20.54 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.907 -0.588 . . . . 25.0 111.623 -175.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.1 p -105.7 150.22 8.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 108.329 -0.989 . . . . 25.0 108.329 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 64.2 mt -131.94 122.84 50.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 104.849 -2.278 . . . . 25.0 104.849 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -106.88 132.96 52.24 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.192 -0.913 . . . . 25.0 109.998 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -124.4 137.73 54.43 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 122.905 0.482 . . . . 25.0 109.76 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.6 p -128.8 138.0 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 114.04 1.126 . . . . 25.0 114.04 -176.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.408 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 15.3 t90 -98.44 121.6 40.59 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 105.086 -2.191 . . . . 25.0 105.086 170.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -106.17 119.35 39.01 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 107.815 -1.18 . . . . 25.0 107.815 -176.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 22.2 mm -84.71 137.97 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 122.031 -0.418 . . . . 25.0 112.092 -171.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -77.9 -45.12 25.01 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.57 -0.706 . . . . 25.0 111.094 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.22 -25.9 65.44 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 114.697 1.369 . . . . 25.0 114.697 -171.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 69.6 p -139.31 165.9 25.96 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.444 0.64 . . . . 25.0 109.607 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.62 29.84 0.25 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.555 -0.748 . . . . 25.0 112.642 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -99.05 147.94 24.53 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.592 0.59 . . . . 25.0 112.592 -177.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.32 144.94 12.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 171.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -146.75 130.62 17.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.996 0.369 . . . . 25.0 111.996 177.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -91.7 118.08 30.34 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.527 0.517 . . . . 25.0 110.776 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -97.17 116.74 29.93 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 107.875 -1.158 . . . . 25.0 107.875 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -89.82 140.16 29.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.951 -0.568 . . . . 25.0 112.117 -176.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.3 tt -126.93 134.31 66.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 105.945 -1.872 . . . . 25.0 105.945 167.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -94.08 130.43 40.24 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.461 -1.311 . . . . 25.0 107.461 176.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.1 m -132.06 162.8 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 113.08 0.77 . . . . 25.0 113.08 -174.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -118.06 95.11 4.76 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 167.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.78 163.9 14.29 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.008 -0.542 . . . . 25.0 112.109 -172.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 63.3 p -143.83 151.82 40.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.686 -0.487 . . . . 25.0 109.686 175.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.905 0 CA-C-O 117.791 -1.099 . . . . 25.0 112.345 -176.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.3 m80 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 121.496 0.665 . . . . 25.0 110.389 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 172.67 170.61 36.62 Favored Glycine 0 CA--C 1.508 -0.395 1 N-CA-C 101.375 -4.69 . . . . 25.0 101.375 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -147.85 164.78 32.6 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 120.402 2.101 . . . . 25.0 110.336 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.7 p -101.03 122.3 52.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 107.639 -1.245 . . . . 25.0 107.639 176.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.61 -42.36 61.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.72 -1.127 . . . . 25.0 109.974 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.5 t -153.34 129.5 5.36 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 106.232 -1.766 . . . . 25.0 106.232 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 164' ' ' ILE . 68.0 Cg_endo -64.76 133.81 17.78 Favored 'Cis proline' 0 CA--C 1.533 0.464 0 C-N-CA 128.791 0.746 . . . . 25.0 111.103 -0.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 110.49 3.21 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.576 0.584 . . . . 25.0 112.576 -172.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.2 t -71.94 157.17 38.33 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 108.265 -1.013 . . . . 25.0 108.265 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.2 mtp180 -55.42 -24.98 33.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.478 0.711 . . . . 25.0 112.272 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.76 -53.99 38.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.826 0.822 . . . . 25.0 109.539 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -68.26 -33.06 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.501 -0.772 . . . . 25.0 110.818 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.9 -33.17 74.74 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 122.009 -0.432 . . . . 25.0 110.449 177.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -65.59 -38.99 91.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.72 -0.474 . . . . 25.0 109.72 178.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -64.48 -36.75 85.21 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.202 0.525 . . . . 25.0 110.263 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.8 mt -78.22 5.8 9.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.037 -0.528 . . . . 25.0 111.473 177.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 58.73 25.74 13.78 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.137 1.375 . . . . 25.0 112.751 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.482 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.1 mt -91.78 -18.88 23.22 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.548 -0.908 . . . . 25.0 108.548 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.482 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -122.35 158.25 30.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 106.896 -1.52 . . . . 25.0 106.896 177.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.9 p -133.93 175.23 9.65 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 122.866 0.466 . . . . 25.0 109.956 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 68.12 5.29 4.55 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.848 1.796 . . . . 25.0 115.848 175.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.1 m -68.66 -35.37 77.15 Favored 'General case' 0 CA--C 1.504 -0.811 0 O-C-N 121.601 -0.687 . . . . 25.0 112.025 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.42 -62.96 1.83 Allowed Glycine 0 C--O 1.22 -0.743 0 O-C-N 123.813 0.695 . . . . 25.0 111.804 -177.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.2 t -88.01 -50.1 6.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 114.74 1.385 . . . . 25.0 114.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 25' ' ' VAL . 2.1 t -65.08 -13.07 14.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 114.549 -1.205 . . . . 25.0 114.146 -165.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -82.59 -9.97 59.17 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.24 -0.984 . . . . 25.0 111.563 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -105.99 -34.09 7.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.266 -0.574 . . . . 25.0 109.479 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -127.1 98.9 29.29 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.638 -0.255 . . . . 25.0 111.246 172.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.16 -21.58 20.2 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 117.281 -1.346 . . . . 25.0 113.907 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -87.97 15.26 7.49 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.193 0.442 . . . . 25.0 112.193 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.8 m -61.62 -25.27 67.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.973 0.416 . . . . 25.0 111.874 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.94 117.93 5.4 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 115.514 1.672 . . . . 25.0 115.514 -173.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -152.95 157.28 40.36 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 105.231 -2.137 . . . . 25.0 105.231 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -160.76 -164.79 16.32 Favored Glycine 0 CA--C 1.51 -0.278 0 N-CA-C 108.656 -1.778 . . . . 25.0 108.656 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.5 tp -118.15 149.79 40.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.432 1.116 . . . . 25.0 112.6 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.88 156.99 31.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.012 -1.107 . . . . 25.0 108.012 171.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.55 -2.77 1.77 Allowed Glycine 0 C--O 1.225 -0.459 0 CA-C-N 114.671 -1.149 . . . . 25.0 113.418 178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.69 140.68 71.53 Favored Pre-proline 0 C--N 1.323 -0.571 0 O-C-N 121.518 -0.99 . . . . 25.0 110.676 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -92.84 -14.15 19.83 Favored 'Cis proline' 0 CA--C 1.543 0.937 0 C-N-CA 130.195 1.331 . . . . 25.0 115.243 -7.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -71.79 -36.87 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.193 1.553 . . . . 25.0 115.193 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.17 34.07 5.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.5 -174.62 44.64 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 114.533 -1.212 . . . . 25.0 111.717 -176.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.53 172.67 1.9 Allowed 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 123.663 2.909 . . . . 25.0 112.85 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.16 159.96 30.99 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 106.858 -1.534 . . . . 25.0 106.858 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.04 140.76 55.41 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.097 -1.446 . . . . 25.0 107.097 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.23 -6.93 77.87 Favored Glycine 0 C--O 1.23 -0.114 0 C-N-CA 121.294 -0.479 . . . . 25.0 112.958 -174.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -124.89 9.68 8.2 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.376 -0.485 . . . . 25.0 109.847 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.9 mt -66.98 -50.75 61.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 122.044 -0.41 . . . . 25.0 111.405 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.06 -21.38 59.95 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 121.92 -0.488 . . . . 25.0 109.839 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.6 p -82.66 -9.46 59.37 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.844 -0.343 . . . . 25.0 111.821 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 51.29 37.61 19.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.721 0.808 . . . . 25.0 110.416 -172.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.6 t70 63.12 32.59 15.11 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.736 1.384 . . . . 25.0 114.736 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -118.97 134.54 55.12 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.785 -0.572 . . . . 25.0 111.973 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 p -62.82 -35.09 78.78 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 115.717 1.747 . . . . 25.0 115.717 -173.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.76 -8.03 49.33 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.254 0.549 . . . . 25.0 112.05 -178.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.688 ' HA ' HD13 ' A' ' 59' ' ' LEU . 10.0 m-85 -121.38 14.71 11.23 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 107.734 -1.21 . . . . 25.0 107.734 -179.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -69.16 -41.14 77.63 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.108 -0.995 . . . . 25.0 111.038 -176.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.8 mp0 -73.87 -11.25 60.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.913 0.863 . . . . 25.0 109.675 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.688 HD13 ' HA ' ' A' ' 56' ' ' PHE . 3.0 mp -86.2 -3.43 58.97 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.011 -1.107 . . . . 25.0 108.011 178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -114.48 -32.87 5.77 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.02 0.378 . . . . 25.0 112.02 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -97.46 120.66 38.23 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 121.477 -0.764 . . . . 25.0 110.299 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.418 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -125.83 160.97 28.46 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.316 -0.857 . . . . 25.0 109.684 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.5 p -114.99 161.19 30.53 Favored Pre-proline 0 C--N 1.318 -0.768 1 N-CA-C 99.58 -4.23 . . . . 25.0 99.58 160.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.57 -2.64 10.39 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 116.823 -1.651 . . . . 25.0 116.127 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -126.1 11.49 7.63 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.754 0.787 . . . . 25.0 111.282 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -79.59 -29.86 41.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.276 -0.89 . . . . 25.0 112.969 -176.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.418 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 11.1 m95 -125.6 167.01 15.68 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 110.022 -0.362 . . . . 25.0 110.022 -177.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -68.2 125.7 27.23 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 172.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.2 mmtt -99.22 106.12 18.24 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 100.202 -3.999 . . . . 25.0 100.202 176.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.85 135.12 52.03 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.175 -0.92 . . . . 25.0 110.495 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -89.77 100.68 13.44 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.848 -1.167 . . . . 25.0 107.848 -178.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.3 mt -131.28 174.03 10.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.244 -1.021 . . . . 25.0 108.244 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.67 155.6 24.19 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.478 -0.783 . . . . 25.0 111.666 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.421 HG22 HD23 ' A' ' 168' ' ' LEU . 54.2 p -77.28 167.21 22.1 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 106.987 -1.486 . . . . 25.0 106.987 172.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.97 -162.08 22.87 Favored Glycine 0 C--O 1.241 0.553 0 N-CA-C 110.712 -0.955 . . . . 25.0 110.712 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 133.87 56.65 Favored 'Trans proline' 0 C--N 1.347 0.45 0 CA-C-N 118.958 1.379 . . . . 25.0 114.043 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.42 159.54 41.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.45 -1.685 . . . . 25.0 106.45 178.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.8 p -106.12 152.97 22.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 106.923 -1.51 . . . . 25.0 106.923 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -138.28 101.06 4.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 105.238 -2.134 . . . . 25.0 105.238 -178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.1 107.78 20.34 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.865 0.84 . . . . 25.0 110.114 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -97.21 146.47 25.06 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.426 -0.806 . . . . 25.0 110.074 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -124.89 112.11 16.24 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.224 -2.139 . . . . 25.0 105.224 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.67 108.5 17.98 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.437 -0.801 . . . . 25.0 111.225 -172.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -71.69 -32.73 68.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.443 0.639 . . . . 25.0 109.861 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.49 117.56 23.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.495 -0.557 . . . . 25.0 109.495 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -72.64 -5.73 39.46 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.654 1.353 . . . . 25.0 114.654 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.94 156.61 23.96 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.84 0.681 . . . . 25.0 112.84 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.6 t -72.87 156.03 39.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 113.762 1.023 . . . . 25.0 113.762 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.431 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 12.4 t -99.96 157.67 16.37 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.527 -0.916 . . . . 25.0 108.527 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -118.12 -14.7 9.91 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.117 0.261 . . . . 25.0 111.617 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.7 t -172.58 152.66 2.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.849 0.356 . . . . 25.0 111.51 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 51.5 m95 -122.92 138.91 54.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 104.599 -2.371 . . . . 25.0 104.599 167.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -143.49 147.03 33.9 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -136.15 132.86 36.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.169 -1.789 . . . . 25.0 106.169 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.83 161.8 41.1 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.446 0.566 . . . . 25.0 110.197 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.29 165.96 30.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 113.427 0.899 . . . . 25.0 113.427 -167.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 112' ' ' PHE . 17.0 p -80.36 160.3 25.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.49 -1.3 . . . . 25.0 107.49 169.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -61.89 159.41 36.3 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.29 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 -24.36 34.51 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 116.256 -2.029 . . . . 25.0 114.234 -173.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -114.43 32.05 6.21 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.398 . . . . 25.0 111.358 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.481 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.0 p-90 -74.15 166.99 22.46 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.952 0.882 . . . . 25.0 112.87 -176.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -83.0 100.99 10.81 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.683 -1.144 . . . . 25.0 110.031 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.481 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.31 15.46 10.47 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 116.421 2.008 . . . . 25.0 116.421 -169.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.7 t -124.29 9.03 8.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.814 -0.81 . . . . 25.0 108.814 175.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -112.52 158.44 37.35 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 114.544 -1.207 . . . . 25.0 108.077 -173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.82 154.61 71.96 Favored 'Trans proline' 0 C--N 1.347 0.481 0 O-C-N 121.863 0.401 . . . . 25.0 111.953 178.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.05 105.14 3.8 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.364 0.602 . . . . 25.0 111.046 -177.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.6 p -94.04 154.43 17.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.352 -0.981 . . . . 25.0 108.352 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -63.59 -26.58 68.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.035 -0.415 . . . . 25.0 111.639 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.86 -25.07 62.65 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.787 -0.642 . . . . 25.0 112.714 177.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.0 t -76.73 -20.79 56.13 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.627 0.727 . . . . 25.0 111.305 -178.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.421 ' HA ' ' HA ' ' A' ' 97' ' ' THR . 55.8 m-85 -88.21 154.95 20.02 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 115.134 1.531 . . . . 25.0 115.134 -176.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -92.3 95.85 9.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 102.301 -3.222 . . . . 25.0 102.301 161.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 79.9 mt -66.96 -6.85 18.42 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.77 1.396 . . . . 25.0 114.77 -169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.0 t -85.97 130.35 50.71 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.314 -0.995 . . . . 25.0 108.314 176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -71.93 148.99 52.55 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 115.509 -2.528 . . . . 25.0 111.457 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -100.07 -9.1 22.99 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.123 0.487 . . . . 25.0 111.266 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 52.0 m -149.23 69.48 1.06 Allowed 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.943 -0.571 . . . . 25.0 109.561 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -88.99 134.58 33.93 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.566 -0.854 . . . . 25.0 109.185 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.51 99.04 5.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 105.849 -1.908 . . . . 25.0 105.849 177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -91.98 92.08 8.14 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.908 -1.145 . . . . 25.0 107.908 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -105.14 118.34 36.28 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 106.796 -1.557 . . . . 25.0 106.796 176.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -100.27 79.9 0.47 Allowed Glycine 0 CA--C 1.502 -0.747 0 CA-C-N 115.554 -0.748 . . . . 25.0 114.082 -167.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 109.84 22.44 6.63 Favored Glycine 0 C--N 1.32 -0.361 0 C-N-CA 120.861 -0.685 . . . . 25.0 112.61 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.27 105.68 5.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.415 0.626 . . . . 25.0 109.343 177.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.49 122.78 87.56 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 105.596 -2.001 . . . . 25.0 105.596 176.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.73 168.11 24.19 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 117.714 -1.057 . . . . 25.0 113.872 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -93.99 24.29 4.36 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.693 -0.855 . . . . 25.0 108.693 176.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.83 -17.97 0.28 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.843 1.657 . . . . 25.0 112.602 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -129.06 148.04 50.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 104.028 -2.582 . . . . 25.0 104.028 170.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.86 94.95 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 107.049 -1.463 . . . . 25.0 107.049 -178.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.4 m -85.71 100.06 11.74 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 107.894 -1.15 . . . . 25.0 107.894 174.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.08 166.53 11.55 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.303 -1.369 . . . . 25.0 107.303 179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -134.64 153.58 51.91 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 105.091 -2.189 . . . . 25.0 105.091 170.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -164.38 160.59 20.93 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.922 -1.14 . . . . 25.0 107.922 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -105.21 117.26 33.56 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.172 0.295 . . . . 25.0 110.948 -176.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.8 mt -79.14 130.95 67.77 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 107.924 -1.139 . . . . 25.0 107.924 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -62.2 147.31 95.26 Favored 'Trans proline' 0 C--N 1.353 0.793 0 CA-C-O 121.682 0.617 . . . . 25.0 113.402 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.418 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.11 -25.65 36.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.222 -0.899 . . . . 25.0 112.653 -169.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 p-10 -83.76 9.4 11.94 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.698 0.761 . . . . 25.0 110.225 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.1 mmt-85 -115.13 53.3 0.83 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.189 -1.041 . . . . 25.0 108.189 171.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 32.3 p -86.11 166.69 15.6 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 106.414 -1.699 . . . . 25.0 106.414 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 88.16 -166.76 35.41 Favored Glycine 0 C--N 1.319 -0.384 0 N-CA-C 115.459 0.944 . . . . 25.0 115.459 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 33.7 t -86.01 108.31 18.17 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.488 0.661 . . . . 25.0 110.938 -168.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.411 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 46.9 p-80 -156.94 171.18 20.91 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.834 -0.621 . . . . 25.0 110.819 -176.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 p -107.8 150.6 10.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 107.983 -1.117 . . . . 25.0 107.983 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 49.8 mt -131.5 120.1 44.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.489 -2.041 . . . . 25.0 105.489 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.56 132.73 51.36 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.302 -0.863 . . . . 25.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -127.04 135.1 50.33 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.993 -0.373 . . . . 25.0 109.993 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.7 p -122.01 144.2 32.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 122.075 0.941 . . . . 25.0 112.572 -177.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.431 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 11.6 t90 -112.48 105.62 13.9 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 105.173 -2.158 . . . . 25.0 105.173 173.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.17 127.37 35.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.569 -1.271 . . . . 25.0 107.569 179.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.0 mm -83.62 140.68 15.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.768 -0.456 . . . . 25.0 109.768 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.38 -42.78 24.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.353 0.597 . . . . 25.0 110.477 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.13 -24.62 65.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.734 1.012 . . . . 25.0 113.734 -172.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 65.6 p -139.49 171.21 14.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.999 0.904 . . . . 25.0 110.206 -174.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.6 20.21 0.74 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.239 -0.891 . . . . 25.0 112.209 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -90.1 146.48 24.28 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.057 0.762 . . . . 25.0 113.057 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.06 144.61 11.48 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -147.95 127.19 12.98 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.345 0.498 . . . . 25.0 112.345 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -84.34 117.13 23.4 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.04 0.448 . . . . 25.0 110.732 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -97.1 112.53 24.26 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.81 141.02 29.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.432 -0.804 . . . . 25.0 111.869 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 7' ' ' PRO . 4.6 tt -125.15 134.87 65.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 105.607 -1.997 . . . . 25.0 105.607 166.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -93.65 131.25 39.14 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.885 -1.524 . . . . 25.0 106.885 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.4 m -132.5 161.24 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.652 0.612 . . . . 25.0 112.652 -175.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -118.68 95.05 4.68 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 103.729 -2.693 . . . . 25.0 103.729 167.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.421 HD23 HG22 ' A' ' 74' ' ' THR . 2.4 tp -90.4 163.18 14.78 Favored 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 112.558 0.577 . . . . 25.0 112.558 -171.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 74.9 p -145.88 164.09 33.04 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.493 -0.929 . . . . 25.0 108.493 177.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.721 0 CA-C-O 118.069 -0.967 . . . . 25.0 110.515 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.0 m80 . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.356 0.598 . . . . 25.0 110.473 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.22 169.58 35.84 Favored Glycine 0 C--N 1.32 -0.348 1 N-CA-C 101.077 -4.809 . . . . 25.0 101.077 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.469 ' HA ' HE22 ' A' ' 162' ' ' GLN . 36.7 p90 -143.97 165.71 27.0 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 120.124 1.962 . . . . 25.0 110.2 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -102.46 121.23 53.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 106.17 -1.789 . . . . 25.0 106.17 176.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -74.04 -41.43 61.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.53 -1.213 . . . . 25.0 109.553 -174.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.6 t -154.17 129.22 4.97 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 105.987 -1.857 . . . . 25.0 105.987 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -65.28 131.56 13.29 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 128.828 0.761 . . . . 25.0 111.543 -0.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.35 113.15 4.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.996 -0.547 . . . . 25.0 111.594 -173.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.4 p -72.13 163.71 27.44 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.273 -0.639 . . . . 25.0 109.273 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -59.73 -21.86 61.25 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.146 0.498 . . . . 25.0 111.797 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.28 -53.68 27.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.934 -0.765 . . . . 25.0 108.934 174.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -66.01 -35.81 81.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.684 -0.689 . . . . 25.0 110.759 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.41 -32.62 74.32 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.13 -0.356 . . . . 25.0 111.024 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 25.0 109.839 177.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -66.77 -36.09 81.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.141 0.496 . . . . 25.0 109.864 177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.4 mt -76.97 3.61 11.84 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.357 -0.383 . . . . 25.0 111.964 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 58.53 21.84 9.03 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.094 1.357 . . . . 25.0 112.836 -178.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.471 ' C ' HD22 ' A' ' 19' ' ' ASN . 95.5 mt -84.72 -21.17 30.19 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.284 -1.376 . . . . 25.0 107.284 173.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.471 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.2 m120 -123.19 157.73 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 104.736 -2.32 . . . . 25.0 104.736 176.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 p -135.26 176.67 8.46 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.575 -0.528 . . . . 25.0 109.575 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 69.83 5.05 5.04 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.536 1.68 . . . . 25.0 115.536 174.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 83.9 m -68.06 -38.84 82.91 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 121.402 -0.811 . . . . 25.0 110.844 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.32 -63.81 1.74 Allowed Glycine 0 C--O 1.217 -0.94 0 O-C-N 123.683 0.614 . . . . 25.0 112.037 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -87.97 -52.45 5.26 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 122.503 1.144 . . . . 25.0 111.889 -178.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.469 HG12 ' HA ' ' A' ' 29' ' ' PRO . 0.8 OUTLIER -67.86 -11.82 14.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.469 -1.241 . . . . 25.0 113.248 -171.83 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -85.6 -1.44 57.13 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 121.739 -0.601 . . . . 25.0 111.487 178.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.41 -34.08 4.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.056 -0.657 . . . . 25.0 110.349 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -127.04 95.79 35.99 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 120.7 0.286 . . . . 25.0 110.349 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' HG12 ' A' ' 25' ' ' VAL . 82.7 Cg_endo -70.63 -19.39 32.04 Favored 'Trans proline' 0 C--N 1.346 0.414 0 N-CA-C 115.05 1.134 . . . . 25.0 115.05 -177.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -87.02 10.92 14.96 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.772 -0.58 . . . . 25.0 112.404 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.9 m -62.52 -18.29 61.64 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.559 0.577 . . . . 25.0 112.559 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 10.1 m -64.13 122.35 14.86 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 114.875 1.435 . . . . 25.0 114.875 -175.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -153.04 155.23 36.48 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.601 -1.629 . . . . 25.0 106.601 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.62 -167.09 19.77 Favored Glycine 0 CA--C 1.512 -0.123 0 N-CA-C 107.838 -2.105 . . . . 25.0 107.838 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 tp -117.93 149.77 40.35 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.536 1.168 . . . . 25.0 111.891 -178.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -65.02 156.93 29.81 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.36 -1.348 . . . . 25.0 107.36 171.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.89 4.57 2.98 Favored Glycine 0 C--N 1.318 -0.424 0 CA-C-N 114.848 -1.069 . . . . 25.0 113.73 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -75.99 143.22 73.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 121.528 -0.983 . . . . 25.0 109.263 -177.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -91.22 -16.93 17.24 Favored 'Cis proline' 0 CA--C 1.543 0.934 0 N-CA-C 115.635 1.36 . . . . 25.0 115.635 -5.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -70.85 -37.75 73.15 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.95 1.463 . . . . 25.0 114.95 -169.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -113.26 28.47 8.76 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.067 -1.827 . . . . 25.0 106.067 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -90.09 -176.43 45.06 Favored Glycine 0 N--CA 1.445 -0.702 0 CA-C-N 114.567 -1.197 . . . . 25.0 110.692 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.59 175.17 1.77 Allowed 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 123.781 2.987 . . . . 25.0 113.222 177.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.04 160.03 31.01 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.683 -1.599 . . . . 25.0 106.683 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.25 140.07 57.23 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 106.892 -1.522 . . . . 25.0 106.892 175.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.33 -5.9 83.26 Favored Glycine 0 C--O 1.229 -0.212 0 CA-C-O 121.349 0.416 . . . . 25.0 112.785 -174.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 60.1 m170 -125.76 8.88 7.58 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.453 -0.44 . . . . 25.0 110.962 178.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.8 mt -64.52 -46.8 91.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 121.915 -0.491 . . . . 25.0 110.968 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -78.39 -12.09 59.98 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 122.078 -0.389 . . . . 25.0 110.482 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.0 p -94.0 -7.58 42.4 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.914 0.709 . . . . 25.0 112.914 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.01 33.97 12.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.555 0.742 . . . . 25.0 110.758 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.2 OUTLIER 61.38 32.55 19.06 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.339 1.237 . . . . 25.0 114.339 -178.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -118.46 137.61 53.05 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.124 0.488 . . . . 25.0 111.608 176.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.4 p -62.85 -34.88 78.27 Favored 'General case' 0 C--O 1.211 -0.95 0 N-CA-C 115.233 1.568 . . . . 25.0 115.233 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.5 t -71.46 -7.41 47.26 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.27 0.557 . . . . 25.0 112.468 -177.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.682 ' HA ' HD13 ' A' ' 59' ' ' LEU . 16.3 m-85 -120.37 12.5 11.69 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 107.161 -1.422 . . . . 25.0 107.161 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -72.12 -35.08 69.04 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.081 -1.012 . . . . 25.0 110.171 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mp0 -70.08 -16.56 63.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.897 0.856 . . . . 25.0 109.864 175.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.682 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.3 mp -87.42 -5.93 58.64 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.599 -0.889 . . . . 25.0 108.599 -176.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -114.14 -31.96 6.16 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 112.384 0.513 . . . . 25.0 112.384 174.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -95.1 118.15 31.41 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.539 -0.726 . . . . 25.0 110.342 -178.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.436 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -126.38 161.01 28.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.109 -0.701 . . . . 25.0 109.109 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.1 p -118.81 161.6 35.28 Favored Pre-proline 0 C--N 1.317 -0.813 0 N-CA-C 100.245 -3.983 . . . . 25.0 100.245 162.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.4 -5.09 15.13 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 116.728 -1.715 . . . . 25.0 115.588 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.4 t -123.66 10.03 9.0 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.063 0.459 . . . . 25.0 111.71 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -79.07 -30.46 43.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.724 0.638 . . . . 25.0 112.724 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.436 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 14.5 m95 -123.51 165.78 16.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 120.698 0.285 . . . . 25.0 110.516 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -67.72 129.17 39.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 105.471 -2.048 . . . . 25.0 105.471 169.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -100.15 105.84 17.49 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 101.249 -3.612 . . . . 25.0 101.249 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 8.1 mp -66.75 135.79 54.51 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.819 -1.082 . . . . 25.0 109.93 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -93.43 106.17 18.16 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.826 -1.079 . . . . 25.0 109.091 -175.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.7 mt -131.64 173.71 10.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.655 -1.239 . . . . 25.0 107.655 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.73 157.34 23.32 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.727 -0.669 . . . . 25.0 110.421 -176.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.454 HG21 ' HA ' ' A' ' 139' ' ' ALA . 66.8 p -77.28 166.76 22.77 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.921 -1.511 . . . . 25.0 106.921 173.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.52 -161.78 23.18 Favored Glycine 0 C--O 1.241 0.539 0 N-CA-C 110.336 -1.106 . . . . 25.0 110.336 -177.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.23 132.54 47.33 Favored 'Trans proline' 0 C--N 1.346 0.408 0 CA-C-N 119.147 1.473 . . . . 25.0 114.288 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -138.93 161.31 37.64 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 106.023 -1.843 . . . . 25.0 106.023 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 39.1 p -103.43 150.91 23.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.007 -1.108 . . . . 25.0 108.007 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -138.15 100.92 4.27 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.467 -2.049 . . . . 25.0 105.467 -178.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.78 116.13 31.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 122.041 0.924 . . . . 25.0 110.023 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -100.48 149.2 23.93 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.151 -0.931 . . . . 25.0 109.85 178.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -127.92 115.05 17.96 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 104.494 -2.409 . . . . 25.0 104.494 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.0 mp -114.37 121.93 45.13 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.101 -0.954 . . . . 25.0 110.791 -172.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.4 t -74.48 -29.72 61.55 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.51 0.671 . . . . 25.0 110.141 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.62 133.38 35.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.03 0.443 . . . . 25.0 110.856 -177.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -77.92 -5.77 52.18 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.748 0.648 . . . . 25.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -63.97 156.86 26.6 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.353 0.872 . . . . 25.0 113.353 -175.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.4 t -77.63 155.97 31.08 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.561 1.319 . . . . 25.0 114.561 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -103.67 156.23 17.95 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.024 -0.535 . . . . 25.0 109.711 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -118.03 -14.81 9.96 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.227 0.454 . . . . 25.0 112.227 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 27.4 t -172.54 154.1 3.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.976 0.417 . . . . 25.0 111.525 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 41.3 m95 -128.06 134.73 49.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.83 -2.285 . . . . 25.0 104.83 168.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 7.1 mtm180 -141.0 149.61 41.99 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.373 -0.973 . . . . 25.0 108.373 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -137.95 135.29 35.89 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 105.731 -1.951 . . . . 25.0 105.731 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.98 160.9 42.88 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.183 0.447 . . . . 25.0 109.938 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.35 166.5 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 112.736 0.643 . . . . 25.0 112.736 -167.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 p -79.6 158.7 27.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.926 -1.139 . . . . 25.0 107.926 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -62.32 158.91 44.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.109 -0.95 . . . . 25.0 109.859 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.52 -15.64 38.11 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 117.894 -0.937 . . . . 25.0 114.179 -174.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -118.66 32.06 6.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.721 0.408 . . . . 25.0 111.882 -176.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.52 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.9 p-90 -79.14 161.58 26.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.819 0.819 . . . . 25.0 112.076 -177.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -83.11 101.03 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.703 -1.135 . . . . 25.0 110.098 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.52 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -83.98 16.68 2.73 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 116.928 2.195 . . . . 25.0 116.928 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.1 t -123.87 5.16 8.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.587 0.708 . . . . 25.0 109.179 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -108.71 157.45 36.68 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 114.838 -1.074 . . . . 25.0 108.499 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -64.71 154.9 70.08 Favored 'Trans proline' 0 C--N 1.346 0.415 0 O-C-N 121.968 0.457 . . . . 25.0 112.695 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.26 112.25 9.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.321 0.581 . . . . 25.0 110.945 -177.028 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.8 p -104.7 156.8 17.66 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.111 -0.7 . . . . 25.0 109.111 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -63.82 -27.04 68.9 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 122.087 -0.383 . . . . 25.0 111.735 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.06 -25.16 61.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.91 -0.586 . . . . 25.0 112.075 177.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.2 t -78.29 -20.43 51.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.177 0.513 . . . . 25.0 111.149 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -89.78 153.86 20.36 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 115.077 1.51 . . . . 25.0 115.077 -176.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -90.8 97.93 11.47 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 103.133 -2.914 . . . . 25.0 103.133 162.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -67.46 -5.87 16.86 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 114.82 1.415 . . . . 25.0 114.82 -170.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -88.44 128.64 52.27 Favored Pre-proline 0 C--N 1.323 -0.549 0 N-CA-C 108.206 -1.035 . . . . 25.0 108.206 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.04 145.73 50.5 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 115.325 -2.65 . . . . 25.0 111.422 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -95.17 -9.13 34.32 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.916 0.389 . . . . 25.0 111.788 -177.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 55.6 m -151.39 69.35 0.94 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.082 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.15 133.57 34.35 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 118.775 -1.17 . . . . 25.0 109.858 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.36 99.06 6.27 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 103.582 -2.747 . . . . 25.0 103.582 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -93.26 92.07 7.54 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 107.229 -1.397 . . . . 25.0 107.229 -178.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -108.81 118.36 36.6 Favored 'General case' 0 C--O 1.216 -0.675 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 178.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -93.61 76.63 1.09 Allowed Glycine 0 CA--C 1.503 -0.705 0 CA-C-N 115.434 -0.803 . . . . 25.0 114.772 -168.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 105.11 25.34 6.79 Favored Glycine 0 C--N 1.319 -0.388 0 C-N-CA 121.011 -0.614 . . . . 25.0 113.122 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.89 106.35 3.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.649 0.738 . . . . 25.0 109.724 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 85.7 mt -69.05 123.72 88.8 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 106.712 -1.588 . . . . 25.0 106.712 177.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.33 172.41 15.4 Favored 'Trans proline' 0 C--N 1.344 0.327 0 N-CA-C 113.887 0.687 . . . . 25.0 113.887 -175.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.407 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -99.53 27.68 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.017 -1.105 . . . . 25.0 108.017 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.24 -9.84 0.58 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.622 1.569 . . . . 25.0 112.129 -173.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' A' ' 128' ' ' ALA . 60.8 mt-30 -131.48 151.65 51.39 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 103.849 -2.649 . . . . 25.0 103.849 170.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -142.1 95.18 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 106.924 -1.51 . . . . 25.0 106.924 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 6.5 t -94.37 126.88 39.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 107.179 -1.415 . . . . 25.0 107.179 175.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -133.17 166.92 21.33 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 105.299 -2.111 . . . . 25.0 105.299 179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -131.33 151.07 51.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 105.018 -2.216 . . . . 25.0 105.018 173.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -157.07 158.95 37.39 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.791 -1.189 . . . . 25.0 107.791 -177.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -102.21 116.17 32.1 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.091 0.245 . . . . 25.0 111.15 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.8 mt -76.91 131.26 73.65 Favored Pre-proline 0 C--O 1.241 0.606 0 N-CA-C 107.623 -1.251 . . . . 25.0 107.623 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -61.37 146.41 97.26 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-O 121.655 0.606 . . . . 25.0 113.527 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.454 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.01 -26.24 36.59 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.186 -0.915 . . . . 25.0 112.588 -168.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -84.31 10.78 9.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 25.0 110.172 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.5 mmt-85 -116.15 50.65 1.02 Allowed 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.45 -0.944 . . . . 25.0 108.45 171.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 40.0 p -85.86 164.63 17.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.491 -1.3 . . . . 25.0 107.491 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.69 -166.91 31.81 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 114.648 0.619 . . . . 25.0 114.648 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.3 t -86.02 112.43 21.22 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.353 0.596 . . . . 25.0 110.354 -169.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -159.46 172.27 18.2 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.711 -0.677 . . . . 25.0 110.317 -176.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.07 151.69 10.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.078 -1.082 . . . . 25.0 108.078 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 56.3 mt -133.13 122.32 45.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 104.895 -2.261 . . . . 25.0 104.895 -178.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.41 134.55 50.3 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.557 -0.747 . . . . 25.0 109.919 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -125.12 134.44 52.45 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.791 0.436 . . . . 25.0 110.078 -178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 8.6 p -124.21 142.91 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 122.322 1.058 . . . . 25.0 112.438 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -111.49 114.58 27.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 105.737 -1.949 . . . . 25.0 105.737 173.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -94.69 122.31 37.16 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.842 -1.17 . . . . 25.0 107.842 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 16.5 mm -78.69 142.42 14.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.543 -0.54 . . . . 25.0 109.543 -177.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.54 -42.94 21.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 118.924 0.784 . . . . 25.0 110.108 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.31 -23.89 64.79 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.649 0.981 . . . . 25.0 113.649 -172.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 52.3 p -139.09 168.61 19.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.901 0.858 . . . . 25.0 109.988 -175.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.24 21.39 0.75 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.285 -0.871 . . . . 25.0 112.334 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -90.7 147.27 23.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.214 0.82 . . . . 25.0 113.214 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -161.35 143.41 11.94 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 105.916 -1.883 . . . . 25.0 105.916 173.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -148.07 128.54 14.02 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.72 0.267 . . . . 25.0 111.72 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -86.96 117.76 25.9 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 120.74 0.305 . . . . 25.0 110.859 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . 0.469 HE22 ' HA ' ' A' ' 3' ' ' TYR . 78.0 mt-30 -97.24 118.7 34.27 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.115 -1.068 . . . . 25.0 108.115 176.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -87.89 142.5 27.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.046 -0.525 . . . . 25.0 111.713 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.6 tt -125.85 134.85 65.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 105.298 -2.112 . . . . 25.0 105.298 166.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.71 129.54 42.89 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 177.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.5 m -132.97 162.11 40.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 113.454 0.909 . . . . 25.0 113.454 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -117.89 95.11 4.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 104.56 -2.385 . . . . 25.0 104.56 168.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.14 163.66 14.76 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 112.397 0.517 . . . . 25.0 112.397 -173.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 71.3 p -145.74 162.95 36.42 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.896 -1.15 . . . . 25.0 107.896 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.778 0 CA-C-O 117.96 -1.019 . . . . 25.0 110.879 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 21.5 m80 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 121.341 0.591 . . . . 25.0 110.602 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.43 164.46 30.52 Favored Glycine 0 C--N 1.321 -0.262 1 N-CA-C 99.904 -5.278 . . . . 25.0 99.904 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -145.6 162.03 38.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.968 2.384 . . . . 25.0 111.625 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -95.01 121.62 45.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 107.95 -1.129 . . . . 25.0 107.95 176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -76.02 -42.78 46.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.456 -1.247 . . . . 25.0 109.809 -175.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.2 t -152.86 128.83 5.19 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 106.154 -1.795 . . . . 25.0 106.154 177.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -63.99 131.74 11.89 Favored 'Cis proline' 0 CA--C 1.534 0.483 0 C-N-CA 128.771 0.738 . . . . 25.0 111.193 -0.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.44 112.61 4.15 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 25.0 112.242 -171.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.9 t -71.97 157.82 37.12 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.378 -0.971 . . . . 25.0 108.378 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -56.12 -24.24 39.46 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.478 0.711 . . . . 25.0 111.826 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.7 -53.09 37.33 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.736 0.779 . . . . 25.0 109.337 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -66.86 -36.72 82.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.599 -0.728 . . . . 25.0 110.482 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -63.38 -31.02 72.07 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.985 -0.286 . . . . 25.0 110.755 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -40.63 95.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.192 0.52 . . . . 25.0 110.276 178.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.485 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 5.4 tmtm? -70.19 -33.55 71.86 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.04 0.448 . . . . 25.0 110.09 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.6 mt -76.14 2.53 12.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.385 -0.37 . . . . 25.0 111.488 174.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 58.1 22.78 9.37 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.353 1.461 . . . . 25.0 113.093 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.465 ' C ' HD22 ' A' ' 19' ' ' ASN . 94.8 mt -85.83 -21.86 27.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.148 -1.427 . . . . 25.0 107.148 173.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.465 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.1 m120 -123.89 159.08 30.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 177.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.9 p -136.72 175.96 9.14 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.881 -0.414 . . . . 25.0 109.881 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 72.62 5.22 5.19 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.523 1.675 . . . . 25.0 115.523 173.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.4 m -67.77 -36.51 80.62 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.671 -0.643 . . . . 25.0 111.282 173.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -63.25 1.67 Allowed Glycine 0 C--O 1.218 -0.858 0 O-C-N 123.552 0.532 . . . . 25.0 112.241 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.1 t -88.09 -53.86 4.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.5 1.143 . . . . 25.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -69.75 -7.15 7.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 114.56 -1.2 . . . . 25.0 113.401 -171.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -88.73 3.16 51.82 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.844 -0.535 . . . . 25.0 111.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -119.77 -33.99 3.87 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.272 -0.571 . . . . 25.0 110.911 173.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.98 107.46 22.07 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 107.746 -1.205 . . . . 25.0 107.746 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.485 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.7 Cg_endo -73.05 -19.23 23.24 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 116.276 -2.016 . . . . 25.0 114.389 -175.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -85.92 9.37 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.356 0.502 . . . . 25.0 112.356 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -61.4 -18.29 58.15 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.814 0.672 . . . . 25.0 112.814 178.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.4 m -65.29 124.21 19.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 N-CA-C 114.721 1.378 . . . . 25.0 114.721 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -152.97 158.8 42.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.303 -1.74 . . . . 25.0 106.303 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.84 -166.57 18.99 Favored Glycine 0 N--CA 1.453 -0.172 0 N-CA-C 107.395 -2.282 . . . . 25.0 107.395 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.8 tp -121.79 149.52 43.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 118.487 1.144 . . . . 25.0 112.31 -177.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -67.03 156.93 34.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 107.126 -1.435 . . . . 25.0 107.126 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 143.18 -5.41 1.9 Allowed Glycine 0 C--N 1.318 -0.457 0 CA-C-N 114.953 -1.022 . . . . 25.0 112.394 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -75.97 145.85 78.15 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.25 -1.018 . . . . 25.0 108.25 -178.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -90.08 -19.99 13.05 Favored 'Cis proline' 0 CA--C 1.542 0.883 0 N-CA-C 115.859 1.446 . . . . 25.0 115.859 -4.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -71.08 -35.61 71.93 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.576 1.324 . . . . 25.0 114.576 -169.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.69 35.98 4.19 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.64 -1.985 . . . . 25.0 105.64 177.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -85.45 175.69 49.51 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.735 -1.121 . . . . 25.0 110.941 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.39 172.93 3.81 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 123.134 2.556 . . . . 25.0 113.616 178.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.0 30.99 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 106.203 -1.777 . . . . 25.0 106.203 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.71 139.56 57.83 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.504 -1.225 . . . . 25.0 107.725 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 -4.98 84.88 Favored Glycine 0 C--O 1.227 -0.316 0 C-N-CA 121.279 -0.486 . . . . 25.0 113.125 -174.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 55.1 m170 -124.82 10.28 8.3 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.349 -0.5 . . . . 25.0 109.816 177.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 73.1 mt -66.25 -45.27 90.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.31 -0.244 . . . . 25.0 110.903 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.44 -27.61 60.68 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.546 -0.539 . . . . 25.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.3 p -79.93 -7.66 58.89 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.459 0.911 . . . . 25.0 113.459 -176.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.71 35.53 18.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.582 0.753 . . . . 25.0 110.294 -173.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 47' ' ' HIS . 0.8 OUTLIER 62.42 30.34 17.29 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 114.646 1.35 . . . . 25.0 114.646 -179.157 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -117.51 137.33 52.62 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.828 -0.545 . . . . 25.0 111.992 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.99 -35.89 81.73 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 115.585 1.698 . . . . 25.0 115.585 -173.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.3 t -71.31 -4.87 28.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.522 0.564 . . . . 25.0 112.522 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.708 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.0 m-85 -123.39 11.9 9.36 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 107.56 -1.274 . . . . 25.0 107.56 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -73.57 -34.79 65.31 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.152 -0.968 . . . . 25.0 109.813 -176.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -71.61 -14.06 61.95 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.871 0.843 . . . . 25.0 109.419 175.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.708 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.6 mp -90.46 -2.26 57.93 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.682 -0.858 . . . . 25.0 108.682 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.43 -32.19 6.0 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.312 0.577 . . . . 25.0 110.969 173.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.8 115.03 24.97 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 121.773 -0.579 . . . . 25.0 110.193 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' CB ' ' HE1' ' A' ' 67' ' ' TRP . 3.1 pm0 -127.62 160.92 30.13 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.129 0.49 . . . . 25.0 110.027 176.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 104' ' ' SER . 33.0 p -119.87 162.45 33.03 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 100.384 -3.932 . . . . 25.0 100.384 162.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -70.12 -3.44 12.26 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 116.32 -1.987 . . . . 25.0 115.853 -175.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -122.37 7.74 9.62 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.656 0.741 . . . . 25.0 111.529 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -76.87 -28.54 55.45 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.345 -0.847 . . . . 25.0 113.204 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.481 ' HE1' ' CB ' ' A' ' 62' ' ' GLN . 10.3 m95 -126.92 167.23 16.14 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.741 0.305 . . . . 25.0 111.337 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -67.77 119.92 13.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.944 -1.873 . . . . 25.0 105.944 169.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.7 mmtt -95.43 105.24 17.19 Favored 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 100.507 -3.886 . . . . 25.0 100.507 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 135.32 54.6 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 114.664 -1.153 . . . . 25.0 110.291 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -92.0 101.73 14.28 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.693 -1.14 . . . . 25.0 108.173 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.6 mt -130.23 173.94 10.29 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.207 -1.034 . . . . 25.0 108.207 -175.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.85 157.33 22.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.364 -0.835 . . . . 25.0 111.224 -175.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.424 HG21 ' HA ' ' A' ' 139' ' ' ALA . 68.5 p -77.36 167.82 21.06 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 106.854 -1.535 . . . . 25.0 106.854 173.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 94.75 -161.87 23.97 Favored Glycine 0 C--O 1.241 0.543 0 N-CA-C 110.856 -0.897 . . . . 25.0 110.856 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.93 133.57 54.48 Favored 'Trans proline' 0 C--N 1.345 0.346 0 CA-C-N 118.989 1.394 . . . . 25.0 114.289 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -140.46 160.26 40.38 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 106.168 -1.79 . . . . 25.0 106.168 178.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 p -104.41 152.36 22.4 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.42 -1.326 . . . . 25.0 107.42 178.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -138.34 100.99 4.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 105.618 -1.993 . . . . 25.0 105.618 -178.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.86 119.21 38.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.876 0.846 . . . . 25.0 109.006 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 69.6 m95 -104.63 148.0 27.02 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.108 -0.951 . . . . 25.0 110.031 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -127.75 107.71 10.12 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.97 125.09 50.87 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 123.958 0.903 . . . . 25.0 112.187 -175.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -80.46 -20.22 44.27 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.297 -1.001 . . . . 25.0 108.297 168.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -83.85 108.62 16.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.85 -0.614 . . . . 25.0 111.586 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -77.63 0.57 22.72 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.869 1.433 . . . . 25.0 114.869 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.6 154.33 42.15 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.057 0.389 . . . . 25.0 110.21 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.5 t -70.57 155.91 40.11 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 114.901 1.445 . . . . 25.0 114.901 -171.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.2 t -97.78 159.37 14.97 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.281 -1.007 . . . . 25.0 108.281 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.5 t -117.77 -16.19 10.02 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 123.145 0.278 . . . . 25.0 111.322 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.5 t -172.13 153.24 3.05 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.991 0.424 . . . . 25.0 112.112 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.88 138.29 53.79 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 103.837 -2.653 . . . . 25.0 103.837 167.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -142.64 147.24 35.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.666 -1.235 . . . . 25.0 107.666 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -135.35 133.47 38.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 106.477 -1.675 . . . . 25.0 106.477 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -147.26 163.22 37.09 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.303 -0.628 . . . . 25.0 109.303 178.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.04 164.93 32.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 114.465 1.283 . . . . 25.0 114.465 -167.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -80.08 158.28 26.47 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 106.934 -1.506 . . . . 25.0 106.934 168.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -63.14 158.72 53.49 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.543 -0.753 . . . . 25.0 109.241 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.89 -20.55 38.92 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 116.681 -1.746 . . . . 25.0 114.252 -174.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -120.55 32.05 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.552 0.575 . . . . 25.0 112.552 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.499 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 6.1 p-90 -71.89 165.51 24.0 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.932 0.873 . . . . 25.0 111.558 -179.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.04 101.01 10.84 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.725 -1.125 . . . . 25.0 109.706 -179.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.499 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.16 15.21 6.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.636 2.087 . . . . 25.0 116.636 -169.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 11.4 t -124.17 9.24 8.61 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.801 -0.815 . . . . 25.0 108.801 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -113.16 156.63 42.69 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 107.465 -1.309 . . . . 25.0 107.465 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.57 156.31 66.19 Favored 'Trans proline' 0 C--N 1.345 0.343 0 O-C-N 121.918 0.431 . . . . 25.0 112.016 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.52 104.24 3.22 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.187 0.517 . . . . 25.0 111.395 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.3 p -92.61 159.56 15.42 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.93 -1.137 . . . . 25.0 107.93 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -65.69 -25.97 67.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.159 0.504 . . . . 25.0 110.719 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.58 -22.48 60.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.481 -0.782 . . . . 25.0 112.745 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 21.2 m -77.39 -12.11 59.92 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.07 0.396 . . . . 25.0 112.07 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -99.77 158.35 15.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 114.555 1.317 . . . . 25.0 114.555 -175.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -96.02 98.23 10.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 102.38 -3.193 . . . . 25.0 102.38 161.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 74.8 mt -66.86 -7.62 23.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 115.003 1.483 . . . . 25.0 115.003 -169.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -83.8 131.37 52.1 Favored Pre-proline 0 C--N 1.323 -0.56 0 N-CA-C 108.706 -0.85 . . . . 25.0 108.706 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -72.54 150.44 51.38 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 115.15 -2.767 . . . . 25.0 111.047 177.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -102.25 -11.85 18.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.399 . . . . 25.0 111.603 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 64.0 m -149.84 66.87 0.99 Allowed 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 116.234 -0.439 . . . . 25.0 110.742 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -89.06 133.47 34.34 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.078 -1.049 . . . . 25.0 109.01 178.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -123.78 99.07 6.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 N-CA-C 104.833 -2.284 . . . . 25.0 104.833 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.9 92.11 8.19 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.129 -1.434 . . . . 25.0 107.129 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -105.98 118.2 36.0 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.065 -1.457 . . . . 25.0 107.065 176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -103.99 82.45 0.37 Allowed Glycine 0 CA--C 1.501 -0.826 0 CA-C-N 115.476 -0.784 . . . . 25.0 112.609 -170.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 119.4 13.99 6.06 Favored Glycine 0 C--N 1.32 -0.332 0 C-N-CA 120.998 -0.62 . . . . 25.0 113.357 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.49 104.0 5.04 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.514 0.673 . . . . 25.0 109.542 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 83.6 mt -73.57 124.5 90.42 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 106.367 -1.716 . . . . 25.0 106.367 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.47 158.74 53.28 Favored 'Trans proline' 0 C--N 1.345 0.384 0 N-CA-C 113.645 0.594 . . . . 25.0 113.645 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -97.48 28.66 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.81 -17.92 0.33 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.962 1.705 . . . . 25.0 111.508 -173.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' A' ' 128' ' ' ALA . 50.2 mt-30 -127.68 150.8 49.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 104.668 -2.345 . . . . 25.0 104.668 169.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 46.0 t -141.02 95.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 106.764 -1.569 . . . . 25.0 106.764 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.9 t -89.65 126.88 35.8 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 107.509 -1.293 . . . . 25.0 107.509 175.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.11 166.86 20.16 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 105.443 -2.058 . . . . 25.0 105.443 177.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -136.01 152.7 51.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 104.825 -2.287 . . . . 25.0 104.825 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.69 159.35 30.16 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.525 -0.917 . . . . 25.0 108.525 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -103.8 115.69 30.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.391 -0.368 . . . . 25.0 110.902 -177.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 62.0 mt -77.01 131.57 72.74 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 107.891 -1.151 . . . . 25.0 107.891 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -61.94 147.11 95.85 Favored 'Trans proline' 0 C--N 1.354 0.861 0 CA-C-O 121.642 0.601 . . . . 25.0 113.504 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.424 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -80.61 -26.77 37.6 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.132 -0.94 . . . . 25.0 112.745 -168.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -82.67 8.45 11.99 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.565 0.698 . . . . 25.0 110.321 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -114.5 51.87 0.87 Allowed 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.816 0.817 . . . . 25.0 109.144 173.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 36.7 p -85.98 163.33 18.05 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 106.912 -1.514 . . . . 25.0 106.912 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 93.6 -169.28 29.95 Favored Glycine 0 N--CA 1.451 -0.359 0 N-CA-C 115.243 0.857 . . . . 25.0 115.243 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.9 t -86.05 108.33 18.21 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.358 0.599 . . . . 25.0 110.86 -168.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . 0.415 ' HA ' ' HE1' ' A' ' 101' ' ' TRP . 43.1 p-80 -157.39 169.44 24.72 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.86 -0.609 . . . . 25.0 112.015 -176.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 4.7 p -105.3 148.16 10.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.697 0 N-CA-C 108.427 -0.953 . . . . 25.0 108.427 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 65.7 mt -131.03 121.21 49.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 104.776 -2.305 . . . . 25.0 104.776 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 10.8 mp -105.14 130.52 53.3 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.32 -0.855 . . . . 25.0 109.963 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -118.16 123.9 46.65 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.043 -0.725 . . . . 25.0 109.043 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 2.9 p -114.11 137.78 46.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.952 0.882 . . . . 25.0 111.653 -178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -112.09 118.99 36.92 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.933 -1.506 . . . . 25.0 106.933 176.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.71 126.45 45.75 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.745 -0.835 . . . . 25.0 108.745 178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 19.3 mm -80.84 143.05 12.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 N-CA-C 109.071 -0.714 . . . . 25.0 109.071 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.98 -45.98 17.47 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.724 0.693 . . . . 25.0 110.212 175.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -68.13 -22.55 64.87 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 114.45 1.278 . . . . 25.0 114.45 -172.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 44.8 p -137.45 168.52 19.48 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.965 0.888 . . . . 25.0 110.084 -174.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -80.41 21.4 0.62 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.097 -0.956 . . . . 25.0 112.533 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -93.62 146.34 23.89 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.024 0.75 . . . . 25.0 113.024 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -159.34 143.62 15.18 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.088 -2.19 . . . . 25.0 105.088 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -148.51 136.05 20.53 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.958 0.725 . . . . 25.0 112.958 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -92.0 113.99 26.42 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.199 0.599 . . . . 25.0 111.598 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -97.1 108.67 21.45 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.056 -0.72 . . . . 25.0 109.056 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -84.24 142.19 30.44 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.596 -0.729 . . . . 25.0 112.198 -177.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.9 tt -126.5 136.37 61.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.264 -2.125 . . . . 25.0 105.264 166.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -97.73 130.35 44.7 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.293 -1.373 . . . . 25.0 107.293 176.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.56 162.8 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 N-CA-C 112.74 0.645 . . . . 25.0 112.74 -174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -118.25 95.04 4.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 104.348 -2.464 . . . . 25.0 104.348 167.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.5 tp -89.99 163.72 14.82 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 112.242 0.46 . . . . 25.0 112.242 -171.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 62.6 p -143.42 154.96 44.24 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 176.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.135 -0.936 . . . . 25.0 111.086 -178.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.0 m170 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.891 0.377 . . . . 25.0 110.658 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.55 165.89 20.37 Favored Glycine 0 C--O 1.229 -0.167 1 N-CA-C 102.362 -4.295 . . . . 25.0 102.362 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -148.04 163.55 36.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 120.561 2.181 . . . . 25.0 111.916 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.3 p -100.2 123.36 53.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 N-CA-C 107.768 -1.197 . . . . 25.0 107.768 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -77.8 -42.61 33.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.604 -1.18 . . . . 25.0 110.265 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -152.45 129.23 5.5 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 105.564 -2.013 . . . . 25.0 105.564 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.91 131.55 11.4 Favored 'Cis proline' 0 C--N 1.348 0.502 0 CA-C-N 118.83 0.618 . . . . 25.0 111.118 -0.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 109.87 2.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.931 -0.577 . . . . 25.0 112.15 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 t -72.03 157.55 37.59 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.167 -1.049 . . . . 25.0 108.167 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -56.09 -24.3 39.41 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.337 0.655 . . . . 25.0 111.985 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.12 -53.69 41.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.803 0.811 . . . . 25.0 109.262 175.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -67.11 -36.42 81.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 25.0 110.463 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -61.92 -32.55 72.96 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 121.106 -0.237 . . . . 25.0 111.028 179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -40.84 97.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.306 0.574 . . . . 25.0 110.519 178.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.472 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 4.4 tmtm? -70.77 -33.04 70.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.066 0.46 . . . . 25.0 110.031 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.1 mt -76.12 5.4 6.83 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.425 -0.352 . . . . 25.0 111.777 175.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 62.9 14.82 7.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.621 1.168 . . . . 25.0 113.352 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.473 ' C ' HD22 ' A' ' 19' ' ' ASN . 91.1 mt -84.06 -22.55 31.18 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.719 -0.845 . . . . 25.0 108.719 176.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.473 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.7 m120 -124.46 158.91 31.7 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 104.792 -2.299 . . . . 25.0 104.792 176.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 67.9 p -137.65 174.01 11.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.081 -0.341 . . . . 25.0 110.081 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 70.25 5.02 5.13 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 116.681 2.104 . . . . 25.0 116.681 176.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.7 m -64.57 -32.33 73.94 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 121.916 -0.49 . . . . 25.0 110.388 172.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.35 -63.08 1.79 Allowed Glycine 0 C--O 1.218 -0.883 0 O-C-N 123.818 0.699 . . . . 25.0 112.023 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.6 t -88.06 -53.48 4.7 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.611 1.196 . . . . 25.0 111.587 -178.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.6 t -68.1 -12.72 16.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.376 -1.284 . . . . 25.0 112.931 -171.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -84.69 -0.82 54.89 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 121.852 -0.53 . . . . 25.0 111.865 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -117.56 -34.16 4.35 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.047 -0.661 . . . . 25.0 110.376 172.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -127.04 104.67 22.63 Favored Pre-proline 0 CA--C 1.54 0.583 0 N-CA-C 109.531 -0.544 . . . . 25.0 109.531 171.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.472 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 87.6 Cg_endo -74.89 -19.78 17.79 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 116.758 -1.695 . . . . 25.0 113.963 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -86.37 12.85 9.19 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.934 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.8 m -66.48 -14.0 61.62 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.754 0.312 . . . . 25.0 111.613 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 56' ' ' PHE . 19.4 m -64.02 129.23 27.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.665 0 N-CA-C 113.839 1.051 . . . . 25.0 113.839 -177.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -152.93 152.4 31.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.383 -1.34 . . . . 25.0 107.383 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.86 -172.96 27.74 Favored Glycine 0 N--CA 1.455 -0.094 0 N-CA-C 108.843 -1.703 . . . . 25.0 108.843 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -124.0 148.27 47.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 118.426 1.113 . . . . 25.0 111.827 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -66.14 156.92 32.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.12 -1.437 . . . . 25.0 107.12 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 135.42 2.13 2.99 Favored Glycine 0 C--N 1.318 -0.45 0 CA-C-N 114.929 -1.032 . . . . 25.0 112.919 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -75.91 141.39 71.52 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.316 -0.994 . . . . 25.0 108.316 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -93.0 -13.46 20.96 Favored 'Cis proline' 0 CA--C 1.543 0.948 0 C-N-CA 130.474 1.447 . . . . 25.0 115.469 -6.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -69.88 -37.07 75.93 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.483 1.29 . . . . 25.0 114.483 -169.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -120.01 30.91 6.77 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.251 -2.129 . . . . 25.0 105.251 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -89.98 179.05 43.92 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 114.358 -1.292 . . . . 25.0 110.899 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -62.6 173.0 3.91 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.743 2.295 . . . . 25.0 113.628 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.1 160.01 30.99 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 107.489 -1.3 . . . . 25.0 107.489 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -60.54 140.02 57.52 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 107.001 -1.481 . . . . 25.0 107.001 174.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.03 -5.01 78.42 Favored Glycine 0 N--CA 1.459 0.176 0 CA-C-O 121.817 0.676 . . . . 25.0 112.583 -174.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -126.03 8.4 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.998 -0.741 . . . . 25.0 108.998 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.94 -52.76 49.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 122.308 -0.245 . . . . 25.0 111.637 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.57 -21.11 59.66 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.372 -0.603 . . . . 25.0 109.372 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.0 p -81.86 -7.62 59.62 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.597 0.592 . . . . 25.0 112.597 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 53.29 31.19 11.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.512 0.725 . . . . 25.0 110.33 -173.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.57 36.58 25.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.715 1.376 . . . . 25.0 114.715 -176.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -120.73 136.29 54.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.992 0.517 . . . . 25.0 110.585 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.3 p -62.08 -33.89 75.27 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 115.234 1.568 . . . . 25.0 115.234 -174.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 55' ' ' THR . 1.5 t -71.12 -7.15 44.62 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.622 0.601 . . . . 25.0 112.622 -178.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.67 ' HA ' HD13 ' A' ' 59' ' ' LEU . 13.7 m-85 -120.84 13.09 11.43 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 107.407 -1.331 . . . . 25.0 107.407 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -71.37 -37.23 71.64 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.243 -0.91 . . . . 25.0 111.338 -176.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -69.82 -17.98 63.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 122.294 1.045 . . . . 25.0 108.757 177.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.67 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.0 OUTLIER -85.51 -8.19 58.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.081 -0.963 . . . . 25.0 109.174 -177.384 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -113.12 -36.13 5.16 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.671 1.36 . . . . 25.0 114.671 176.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -104.92 125.94 51.46 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.102 -0.999 . . . . 25.0 110.821 -176.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.5 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.4 pm0 -127.73 161.05 29.84 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.286 -1.325 . . . . 25.0 110.029 -176.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.8 p -112.6 162.66 20.54 Favored Pre-proline 0 C--N 1.319 -0.75 0 N-CA-C 100.663 -3.829 . . . . 25.0 100.663 161.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -70.45 -0.14 7.04 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 N-CA-C 116.129 1.55 . . . . 25.0 116.129 -174.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 t -127.92 13.64 6.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.587 0.708 . . . . 25.0 110.251 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.85 -30.48 45.19 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.825 1.046 . . . . 25.0 113.825 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.5 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 15.8 m95 -126.77 167.89 15.16 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.599 -0.519 . . . . 25.0 109.599 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -66.46 126.89 30.27 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.246 -1.761 . . . . 25.0 106.246 171.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -98.97 106.19 18.42 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 100.543 -3.873 . . . . 25.0 100.543 177.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.63 134.66 52.77 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.06 -0.973 . . . . 25.0 110.259 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -91.69 100.66 13.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.691 -1.14 . . . . 25.0 108.021 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.5 mt -131.89 173.96 10.65 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.135 -1.061 . . . . 25.0 108.135 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.78 156.38 23.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.61 -0.723 . . . . 25.0 110.944 -176.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 139' ' ' ALA . 53.3 p -77.13 167.9 20.99 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.163 -1.421 . . . . 25.0 107.163 172.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.26 -160.78 23.04 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 110.518 -1.033 . . . . 25.0 110.518 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -58.87 132.98 50.81 Favored 'Trans proline' 0 C--N 1.345 0.387 0 CA-C-N 119.202 1.501 . . . . 25.0 114.079 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -140.31 161.98 36.39 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.506 -1.665 . . . . 25.0 106.506 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.7 p -101.52 150.86 22.63 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.829 -1.175 . . . . 25.0 107.829 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -137.66 100.96 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.22 -2.141 . . . . 25.0 105.22 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.98 121.46 45.41 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 123.923 0.889 . . . . 25.0 109.52 -177.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -107.36 152.18 24.51 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.035 -0.984 . . . . 25.0 110.161 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -129.35 114.54 16.33 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 104.789 -2.3 . . . . 25.0 104.789 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.8 mp -115.05 117.87 31.8 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.385 -0.825 . . . . 25.0 112.193 -173.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -81.91 6.58 15.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.302 0.572 . . . . 25.0 111.272 173.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -122.62 132.32 54.23 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.979 -0.451 . . . . 25.0 110.345 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -80.63 -9.63 59.78 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.874 0.694 . . . . 25.0 112.874 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -64.15 155.58 31.16 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.19 0.441 . . . . 25.0 112.19 -176.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 t -76.99 155.89 32.3 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.819 0.818 . . . . 25.0 112.859 -175.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.463 ' HB ' ' HE1' ' A' ' 151' ' ' TRP . 6.6 t -97.92 158.24 15.64 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.502 -1.296 . . . . 25.0 107.502 173.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.0 t -117.92 -15.6 9.98 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.102 0.251 . . . . 25.0 111.195 172.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -171.99 150.25 2.52 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.312 0.486 . . . . 25.0 112.312 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -123.94 138.54 54.45 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 104.457 -2.423 . . . . 25.0 104.457 167.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.6 mtt-85 -137.27 144.76 42.87 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.425 -1.324 . . . . 25.0 107.425 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -137.94 127.52 25.05 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.686 -1.598 . . . . 25.0 106.686 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -147.74 168.76 21.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.675 -0.861 . . . . 25.0 108.675 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.51 167.38 26.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 113.394 0.887 . . . . 25.0 113.394 -168.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.3 p -79.06 160.53 27.07 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.735 . . . . 25.0 106.317 167.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -62.13 159.0 41.66 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.708 -0.678 . . . . 25.0 109.553 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.26 -24.53 37.6 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 116.923 -1.584 . . . . 25.0 113.056 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -115.02 32.06 6.28 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.092 0.557 . . . . 25.0 110.762 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.509 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 5.6 p-90 -72.68 165.42 24.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 122.135 0.969 . . . . 25.0 113.577 -174.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -83.17 101.04 10.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.377 -1.283 . . . . 25.0 110.293 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.509 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -87.93 7.99 28.34 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 117.715 2.487 . . . . 25.0 117.715 -168.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.0 t -123.44 8.32 9.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.778 0.799 . . . . 25.0 109.231 176.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -107.25 160.52 26.18 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 114.541 -1.209 . . . . 25.0 108.916 -172.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -64.53 152.51 81.42 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 118.051 -0.833 . . . . 25.0 111.412 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.2 mp -71.59 100.14 2.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.498 0.666 . . . . 25.0 110.868 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -88.96 153.97 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 107.503 -1.295 . . . . 25.0 107.503 176.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.21 -25.93 68.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.257 0.551 . . . . 25.0 111.167 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.23 -22.47 61.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.333 -0.849 . . . . 25.0 112.801 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.4 t -79.29 -3.93 48.36 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 112.196 0.443 . . . . 25.0 112.196 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -106.01 155.58 19.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -174.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -96.47 91.24 5.7 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 101.952 -3.351 . . . . 25.0 101.952 161.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.4 mt -69.82 -7.11 37.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.512 0.93 . . . . 25.0 113.512 -171.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.39 119.6 77.79 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.862 -1.162 . . . . 25.0 107.862 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -72.09 143.27 39.85 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 114.998 -2.868 . . . . 25.0 112.416 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -95.0 -14.59 24.22 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.064 0.394 . . . . 25.0 112.064 -176.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 75.1 m -147.94 62.77 1.12 Allowed 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.827 0.306 . . . . 25.0 111.827 178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -88.96 139.46 30.43 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 118.24 -1.384 . . . . 25.0 108.705 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -124.92 99.12 5.99 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 104.261 -2.496 . . . . 25.0 104.261 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -92.47 92.12 7.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.016 -1.476 . . . . 25.0 107.016 -176.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -106.15 117.9 35.24 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.438 -0.949 . . . . 25.0 108.438 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -96.92 77.88 0.69 Allowed Glycine 0 CA--C 1.504 -0.628 0 CA-C-N 115.45 -0.795 . . . . 25.0 114.023 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 115.93 20.39 5.3 Favored Glycine 0 C--N 1.321 -0.275 0 C-N-CA 120.882 -0.675 . . . . 25.0 113.862 178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.38 105.13 5.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.497 0.665 . . . . 25.0 109.828 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 89.3 mt -72.24 125.99 91.24 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 105.563 -2.014 . . . . 25.0 105.563 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -74.5 169.14 23.19 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 118.369 -0.621 . . . . 25.0 113.598 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.411 ' C ' ' H ' ' A' ' 130' ' ' GLN . . . -103.22 31.49 4.26 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.372 -1.344 . . . . 25.0 107.372 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 70.66 -17.94 0.27 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 125.94 1.696 . . . . 25.0 112.132 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 128' ' ' ALA . 59.9 mt-30 -129.25 155.47 45.52 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 104.703 -2.332 . . . . 25.0 104.703 171.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.1 t -140.72 95.03 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 105.417 -2.068 . . . . 25.0 105.417 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.9 t -95.52 142.58 27.7 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -156.95 167.03 31.68 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 113.709 -1.587 . . . . 25.0 108.628 -175.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -129.77 156.89 43.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.88 -1.526 . . . . 25.0 106.88 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -161.12 161.35 31.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.483 -1.302 . . . . 25.0 107.483 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -105.09 117.16 33.3 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.085 0.241 . . . . 25.0 111.101 -177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.54 132.25 69.48 Favored Pre-proline 0 CA--C 1.541 0.628 0 N-CA-C 107.888 -1.152 . . . . 25.0 107.888 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -61.26 145.75 98.14 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-O 121.705 0.627 . . . . 25.0 113.472 -179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.429 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.62 -25.64 35.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.178 -0.919 . . . . 25.0 112.665 -168.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 25.8 p-10 -84.24 9.77 12.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.611 0.719 . . . . 25.0 110.212 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -115.18 53.55 0.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.345 -0.983 . . . . 25.0 108.345 171.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.9 p -86.12 165.45 16.59 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 106.748 -1.575 . . . . 25.0 106.748 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.14 -167.08 32.68 Favored Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 115.368 0.907 . . . . 25.0 115.368 177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.7 t -86.0 108.13 18.09 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.959 0.409 . . . . 25.0 110.799 -168.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 38.5 p-80 -158.53 168.39 27.04 Favored 'General case' 0 C--O 1.22 -0.489 0 N-CA-C 113.816 1.043 . . . . 25.0 113.816 -174.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 16.1 t -100.91 146.24 9.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.376 -0.972 . . . . 25.0 108.376 -179.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.81 129.65 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 102.114 -3.291 . . . . 25.0 102.114 179.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.44 132.57 54.98 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.522 179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -113.09 111.88 22.88 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.311 -1.366 . . . . 25.0 107.311 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -106.31 142.19 19.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.356 0.598 . . . . 25.0 110.087 -176.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.463 ' HE1' ' HB ' ' A' ' 89' ' ' THR . 18.2 t90 -123.63 124.31 42.49 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.0 -1.0 . . . . 25.0 108.608 -179.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -105.21 129.46 53.58 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.998 -0.742 . . . . 25.0 108.998 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 23.2 mm -85.97 141.11 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.313 -0.625 . . . . 25.0 109.313 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -79.39 -44.78 20.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.714 0.688 . . . . 25.0 110.528 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -23.33 64.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.077 1.14 . . . . 25.0 114.077 -171.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 51.5 p -138.39 169.9 16.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 122.046 0.926 . . . . 25.0 110.32 -174.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -79.97 19.05 0.73 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.999 -1.0 . . . . 25.0 112.325 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -90.3 147.62 23.38 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.66 -0.65 . . . . 25.0 112.528 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.05 144.67 19.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 104.414 -2.439 . . . . 25.0 104.414 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -143.43 147.94 35.37 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.721 0.237 . . . . 25.0 110.51 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -109.4 107.76 18.04 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.856 0.863 . . . . 25.0 109.666 -174.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -97.01 108.13 20.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.189 0.519 . . . . 25.0 110.142 -177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -86.56 145.93 26.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.953 -0.567 . . . . 25.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.87 147.09 32.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 103.782 -2.673 . . . . 25.0 103.782 168.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -110.75 130.64 55.52 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 106.241 -1.762 . . . . 25.0 106.241 176.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.0 m -132.76 162.45 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.738 0.644 . . . . 25.0 112.738 -173.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -117.98 95.12 4.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 104.336 -2.468 . . . . 25.0 104.336 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.89 163.99 13.83 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 112.919 0.711 . . . . 25.0 112.919 -171.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 68.4 p -144.74 164.43 31.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 107.977 -1.12 . . . . 25.0 107.977 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.839 0 CA-C-O 117.592 -1.194 . . . . 25.0 111.959 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.1 m170 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.332 -0.248 . . . . 25.0 110.332 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.33 165.14 33.04 Favored Glycine 0 CA--C 1.509 -0.284 1 N-CA-C 102.887 -4.085 . . . . 25.0 102.887 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -145.78 158.4 43.86 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 119.668 1.734 . . . . 25.0 110.984 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.15 119.56 34.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.564 -1.643 . . . . 25.0 106.564 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.72 -43.15 48.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.279 -1.328 . . . . 25.0 109.319 -174.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.8 t -155.37 128.38 4.26 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 106.173 -1.788 . . . . 25.0 106.173 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -63.9 128.52 7.13 Favored 'Cis proline' 0 CA--C 1.538 0.719 0 C-N-CA 129.706 1.128 . . . . 25.0 112.346 0.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.75 116.83 8.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.777 0.658 . . . . 25.0 112.777 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.4 t -72.11 157.84 37.02 Favored 'General case' 0 C--O 1.216 -0.665 0 N-CA-C 109.011 -0.737 . . . . 25.0 109.011 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.4 mtp180 -55.93 -25.12 41.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.602 0.761 . . . . 25.0 111.656 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -52.76 44.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.755 0.788 . . . . 25.0 109.155 175.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.94 -36.72 84.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.462 -0.79 . . . . 25.0 110.308 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -63.65 -33.74 76.29 Favored 'General case' 0 C--O 1.219 -0.531 0 O-C-N 122.223 -0.298 . . . . 25.0 110.899 178.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -40.26 96.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.342 0.591 . . . . 25.0 109.915 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.423 ' HG3' ' HD3' ' A' ' 29' ' ' PRO . 6.3 tmtm? -68.45 -33.85 74.92 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.212 0.529 . . . . 25.0 110.311 178.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.5 mt -79.08 5.14 12.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.114 -0.494 . . . . 25.0 111.276 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 58.7 24.77 12.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.177 1.391 . . . . 25.0 112.909 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.457 ' C ' HD22 ' A' ' 19' ' ' ASN . 89.3 mt -89.7 -21.44 22.72 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.914 -1.143 . . . . 25.0 107.914 174.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.457 HD22 ' C ' ' A' ' 18' ' ' LEU . 2.3 m120 -123.51 160.28 27.3 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 105.669 -1.974 . . . . 25.0 105.669 177.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 42.6 p -134.31 175.13 9.78 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 122.449 0.3 . . . . 25.0 110.456 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 69.39 5.23 5.03 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.877 1.806 . . . . 25.0 115.877 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -66.67 -38.52 86.99 Favored 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 121.344 -0.848 . . . . 25.0 111.145 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -63.33 1.54 Allowed Glycine 0 C--O 1.218 -0.9 0 O-C-N 123.55 0.531 . . . . 25.0 112.449 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -53.73 4.61 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.549 1.166 . . . . 25.0 111.806 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -7.03 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 114.603 -1.18 . . . . 25.0 113.63 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.419 ' H ' ' HG2' ' A' ' 26' ' ' GLN . 13.6 pt20 -88.27 2.0 53.32 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.8 -0.563 . . . . 25.0 111.102 178.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -117.65 -34.05 4.36 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.742 -0.383 . . . . 25.0 110.791 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -126.93 107.62 22.2 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 107.054 -1.462 . . . . 25.0 107.054 172.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.423 ' HD3' ' HG3' ' A' ' 15' ' ' LYS . 84.1 Cg_endo -76.9 -18.55 14.71 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 116.867 -1.622 . . . . 25.0 113.797 -171.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -90.66 12.01 20.34 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.64 0.607 . . . . 25.0 112.64 -177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.0 m -62.18 -17.93 59.5 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.092 0.472 . . . . 25.0 112.121 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.418 ' H ' HG22 ' A' ' 32' ' ' VAL . 2.2 m -64.1 120.65 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.81 0.814 . . . . 25.0 112.695 -179.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -152.99 156.5 38.96 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 105.077 -2.194 . . . . 25.0 105.077 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -161.56 -169.05 24.34 Favored Glycine 0 CA--C 1.51 -0.236 0 N-CA-C 109.28 -1.528 . . . . 25.0 109.28 -176.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.7 tp -118.18 147.77 43.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.216 1.008 . . . . 25.0 111.917 -176.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.46 156.88 31.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.881 -1.155 . . . . 25.0 107.881 172.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 139.95 1.69 1.76 Allowed Glycine 0 C--O 1.223 -0.536 0 CA-C-N 114.768 -1.105 . . . . 25.0 113.195 179.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -75.99 139.07 69.07 Favored Pre-proline 0 C--N 1.321 -0.655 0 O-C-N 121.569 -0.959 . . . . 25.0 109.631 -175.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.2 -13.13 21.23 Favored 'Cis proline' 0 CA--C 1.544 1.011 0 C-N-CA 130.438 1.433 . . . . 25.0 115.509 -6.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -71.63 -36.76 70.86 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.349 1.611 . . . . 25.0 115.349 -168.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.69 31.95 5.74 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.724 -1.954 . . . . 25.0 105.724 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.26 -174.42 42.05 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 114.336 -1.302 . . . . 25.0 110.859 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -61.96 170.26 6.33 Favored 'Trans proline' 0 C--O 1.242 0.72 0 C-N-CA 122.446 2.097 . . . . 25.0 113.097 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.99 159.97 31.12 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 106.592 -1.633 . . . . 25.0 106.592 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.62 138.84 58.01 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.563 -1.199 . . . . 25.0 108.34 177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.36 -4.12 82.46 Favored Glycine 0 C--O 1.227 -0.296 0 C-N-CA 121.216 -0.516 . . . . 25.0 112.844 -174.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -124.45 9.08 8.42 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.656 -0.868 . . . . 25.0 108.656 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.79 -47.27 86.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 O-C-N 122.405 -0.185 . . . . 25.0 110.906 -172.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.02 -18.46 58.13 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 122.024 -0.423 . . . . 25.0 110.182 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 p -87.97 -7.17 57.48 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.586 0.587 . . . . 25.0 112.586 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 52.41 32.81 11.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.659 0.784 . . . . 25.0 110.412 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 58.96 37.08 24.69 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.558 1.318 . . . . 25.0 114.558 -177.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -120.7 137.28 54.55 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.124 0.569 . . . . 25.0 111.11 175.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.7 p -62.62 -35.43 79.54 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 115.378 1.621 . . . . 25.0 115.378 -174.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -71.56 -6.97 44.68 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.615 0.598 . . . . 25.0 112.615 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.684 ' HA ' HD13 ' A' ' 59' ' ' LEU . 14.6 m-85 -120.44 11.91 11.51 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 107.32 -1.363 . . . . 25.0 107.32 -179.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.62 -34.47 67.35 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.051 -1.031 . . . . 25.0 110.084 -175.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.8 mp0 -71.27 -15.56 62.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.947 0.879 . . . . 25.0 109.945 174.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.684 HD13 ' HA ' ' A' ' 56' ' ' PHE . 1.8 mp -87.91 -6.48 58.04 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.321 -0.992 . . . . 25.0 108.321 -177.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -111.55 -32.36 6.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.097 0.475 . . . . 25.0 111.81 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -98.15 121.91 40.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 121.743 -0.598 . . . . 25.0 110.052 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' HB3' ' HE1' ' A' ' 67' ' ' TRP . 3.3 pm0 -129.68 160.97 31.69 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.022 -0.733 . . . . 25.0 109.022 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.7 p -115.79 162.39 25.64 Favored Pre-proline 0 C--N 1.321 -0.666 1 N-CA-C 100.108 -4.034 . . . . 25.0 100.108 162.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.9 -4.9 14.34 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 116.744 -1.704 . . . . 25.0 115.586 -175.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 11.8 t -125.15 10.7 8.13 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.079 0.466 . . . . 25.0 111.783 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -77.72 -30.14 51.59 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.657 -0.652 . . . . 25.0 112.593 -176.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.457 ' HE1' ' HB3' ' A' ' 62' ' ' GLN . 10.4 m95 -125.07 164.7 19.63 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.85 -0.426 . . . . 25.0 109.85 -178.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -66.83 129.15 38.95 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.016 -1.846 . . . . 25.0 106.016 171.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -100.9 105.54 16.81 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 100.694 -3.817 . . . . 25.0 100.694 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.9 mp -68.54 136.31 52.92 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.12 -0.946 . . . . 25.0 110.784 -176.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -88.26 111.92 22.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.915 -1.039 . . . . 25.0 108.856 -177.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.1 mt -137.09 173.19 11.96 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.143 -1.058 . . . . 25.0 108.143 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.22 156.3 25.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.704 -0.68 . . . . 25.0 110.467 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.442 HG21 ' HA ' ' A' ' 139' ' ' ALA . 70.5 p -76.95 170.47 16.45 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.829 -1.174 . . . . 25.0 107.829 173.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 92.44 -161.87 26.54 Favored Glycine 0 C--O 1.239 0.456 0 CA-C-O 118.95 -0.917 . . . . 25.0 110.95 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -58.94 131.2 40.42 Favored 'Trans proline' 0 C--N 1.345 0.345 0 CA-C-N 119.149 1.475 . . . . 25.0 113.517 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -139.26 163.11 33.33 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.093 -1.447 . . . . 25.0 107.093 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.8 p -104.17 152.45 22.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.03 -1.1 . . . . 25.0 108.03 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -140.62 101.09 4.01 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 104.917 -2.253 . . . . 25.0 104.917 -177.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.98 134.98 49.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 N-CA-C 107.115 -1.439 . . . . 25.0 107.115 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -120.35 153.21 36.79 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.962 -1.472 . . . . 25.0 109.542 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -130.44 117.25 19.39 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 104.21 -2.515 . . . . 25.0 104.21 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.1 mp -116.9 137.64 52.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.139 -0.937 . . . . 25.0 111.22 -173.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 11.8 t -92.75 2.36 56.78 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.984 0.421 . . . . 25.0 111.219 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -128.57 139.46 52.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.932 0.396 . . . . 25.0 111.142 -177.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 57.3 mmm-85 -92.06 1.77 56.99 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.895 -0.593 . . . . 25.0 112.49 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.25 148.81 49.31 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.591 -0.444 . . . . 25.0 110.083 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.4 t -71.8 155.93 39.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 114.078 1.14 . . . . 25.0 114.078 -170.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.448 HG21 ' HE1' ' A' ' 92' ' ' TRP . 14.8 t -99.03 159.45 14.95 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.179 -1.045 . . . . 25.0 108.179 173.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 t -117.96 -13.75 10.03 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.125 0.266 . . . . 25.0 110.589 170.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.6 t -172.62 151.87 2.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.803 0.335 . . . . 25.0 111.325 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.448 ' HE1' HG21 ' A' ' 89' ' ' THR . 63.1 m95 -122.72 141.51 51.71 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.274 -2.491 . . . . 25.0 104.274 165.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -145.34 152.98 40.74 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.727 -1.212 . . . . 25.0 107.727 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -136.71 134.81 37.58 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 105.786 -1.931 . . . . 25.0 105.786 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -147.59 165.23 31.0 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.196 0.453 . . . . 25.0 109.822 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.01 167.83 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 113.713 1.005 . . . . 25.0 113.713 -166.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 8.9 p -82.25 163.78 21.62 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.235 -1.024 . . . . 25.0 108.235 168.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.39 159.38 41.26 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.349 -0.842 . . . . 25.0 109.355 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -68.87 -24.23 34.2 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 116.063 -2.158 . . . . 25.0 113.581 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -115.58 31.87 6.43 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 122.915 0.486 . . . . 25.0 111.069 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . 0.495 ' CZ3' ' HA ' ' A' ' 103' ' ' ALA . 7.0 p-90 -71.98 166.57 21.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.13 0.967 . . . . 25.0 112.524 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.06 101.04 10.87 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.51 -1.223 . . . . 25.0 109.212 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.495 ' HA ' ' CZ3' ' A' ' 101' ' ' TRP . . . -90.11 15.13 10.76 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 116.041 1.867 . . . . 25.0 116.041 -169.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -128.1 13.2 6.71 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.701 -0.852 . . . . 25.0 108.701 176.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -117.54 157.24 48.11 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 114.521 -1.218 . . . . 25.0 107.976 -174.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -64.93 153.2 79.33 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 O-C-N 121.961 0.453 . . . . 25.0 111.798 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.63 103.77 4.34 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.58 0.705 . . . . 25.0 112.308 -175.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 19.9 p -98.02 161.41 13.74 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.157 -0.683 . . . . 25.0 109.157 177.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -68.03 -23.39 64.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.234 0.54 . . . . 25.0 111.029 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.69 63.4 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.212 -0.904 . . . . 25.0 112.034 176.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.3 m -85.65 -9.73 56.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.115 0.483 . . . . 25.0 111.415 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -95.54 154.58 17.13 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 114.363 1.245 . . . . 25.0 114.363 -177.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -97.74 94.27 6.85 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 102.512 -3.144 . . . . 25.0 102.512 161.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.47 -7.51 20.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.569 1.322 . . . . 25.0 114.569 -170.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.9 t -81.79 132.47 54.43 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 109.061 -0.718 . . . . 25.0 109.061 177.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -72.66 150.92 51.54 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 115.01 -2.86 . . . . 25.0 110.615 176.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -102.32 -9.84 20.01 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.961 0.41 . . . . 25.0 111.17 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 47.7 m -151.86 70.82 0.95 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 25.0 109.793 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -89.08 135.14 33.72 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.06 -1.056 . . . . 25.0 108.964 176.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -121.22 99.1 6.3 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 103.168 -2.901 . . . . 25.0 103.168 177.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -90.32 91.93 8.7 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 107.085 -1.45 . . . . 25.0 107.085 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -113.68 118.44 34.36 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 107.763 -1.199 . . . . 25.0 107.763 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -105.32 83.71 0.38 Allowed Glycine 0 CA--C 1.5 -0.874 0 CA-C-N 115.311 -0.859 . . . . 25.0 112.564 -170.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 118.33 14.04 6.64 Favored Glycine 0 C--N 1.32 -0.313 0 C-N-CA 121.054 -0.593 . . . . 25.0 113.253 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -74.31 105.56 5.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.58 0.705 . . . . 25.0 109.334 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 86.0 mt -74.39 121.62 85.64 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 107.039 -1.467 . . . . 25.0 107.039 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -72.32 162.89 40.28 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 118.267 -0.689 . . . . 25.0 112.933 -178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -100.14 27.58 5.51 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.665 -0.865 . . . . 25.0 108.665 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 71.03 -9.79 0.82 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.604 1.561 . . . . 25.0 111.676 -174.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -132.26 151.81 51.65 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 103.49 -2.782 . . . . 25.0 103.49 170.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 49.4 t -142.03 95.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 106.576 -1.638 . . . . 25.0 106.576 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 10.0 t -90.99 138.36 31.67 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 105.274 -2.121 . . . . 25.0 105.274 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.49 164.93 30.97 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 106.287 -1.746 . . . . 25.0 106.287 -179.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -136.46 149.01 48.01 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.962 -2.236 . . . . 25.0 104.962 174.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.82 160.94 31.77 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.328 -1.36 . . . . 25.0 107.328 -176.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -101.16 118.44 36.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.528 0.204 . . . . 25.0 111.368 -177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.3 mt -78.94 132.64 63.35 Favored Pre-proline 0 CA--C 1.541 0.625 0 N-CA-C 107.831 -1.174 . . . . 25.0 107.831 176.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -61.52 146.84 96.64 Favored 'Trans proline' 0 C--N 1.355 0.872 0 CA-C-O 121.611 0.588 . . . . 25.0 113.492 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.442 ' HA ' HG21 ' A' ' 74' ' ' THR . . . -81.84 -26.83 33.95 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.162 -0.927 . . . . 25.0 112.56 -169.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -84.35 9.48 13.04 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.582 -0.736 . . . . 25.0 110.376 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -113.32 52.98 0.78 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.677 -0.86 . . . . 25.0 108.677 171.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 34.1 p -85.99 161.72 18.85 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 106.945 -1.502 . . . . 25.0 106.945 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 90.48 -165.41 31.14 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 115.562 0.985 . . . . 25.0 115.562 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.1 t -85.82 109.05 18.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.443 0.64 . . . . 25.0 111.267 -168.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' HIS . . . . . . . . . . . . . 44.5 p-80 -158.31 171.51 20.04 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.777 -0.647 . . . . 25.0 110.379 -176.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.37 150.64 7.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 107.54 -1.282 . . . . 25.0 107.54 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 51.5 mt -132.99 129.29 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 N-CA-C 101.478 -3.527 . . . . 25.0 101.478 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.9 mp -119.22 137.53 53.58 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.102 -0.499 . . . . 25.0 109.78 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -119.02 134.68 55.04 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 109.561 -0.533 . . . . 25.0 109.561 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 5.9 p -124.52 140.09 48.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 122.126 0.965 . . . . 25.0 111.762 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -111.44 109.7 19.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 113.495 -1.684 . . . . 25.0 106.675 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -91.08 121.5 32.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.431 -1.322 . . . . 25.0 107.431 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 20.2 mm -79.65 141.75 14.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.528 -0.545 . . . . 25.0 109.528 -178.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -80.33 -42.14 23.51 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.699 0.681 . . . . 25.0 110.163 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.0 -24.72 65.16 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.592 0.96 . . . . 25.0 113.592 -172.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 63.5 p -139.53 169.52 17.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.938 0.875 . . . . 25.0 110.084 -174.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -81.04 23.67 0.55 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.193 -0.912 . . . . 25.0 112.295 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -92.77 146.28 23.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.991 0.738 . . . . 25.0 112.991 -176.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -162.25 143.12 10.35 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.785 -1.932 . . . . 25.0 105.785 172.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -148.77 132.87 17.27 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 111.676 0.25 . . . . 25.0 111.676 178.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.12 114.9 26.22 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.414 0.446 . . . . 25.0 110.821 178.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -97.11 108.14 20.81 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.65 -0.87 . . . . 25.0 108.65 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -81.26 139.9 35.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.236 -0.893 . . . . 25.0 113.201 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 4.1 tt -125.98 132.69 70.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 105.998 -1.853 . . . . 25.0 105.998 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -91.39 130.28 37.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.377 -1.342 . . . . 25.0 107.377 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.83 162.19 39.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.941 0.719 . . . . 25.0 112.941 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -119.95 95.64 4.85 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 104.47 -2.418 . . . . 25.0 104.47 168.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.41 HD23 HG22 ' A' ' 74' ' ' THR . 2.0 tp -90.03 163.23 14.99 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.483 0.549 . . . . 25.0 112.483 -172.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 64.2 p -143.36 156.31 44.65 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.944 -1.132 . . . . 25.0 107.944 176.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.822 0 CA-C-O 118.013 -0.994 . . . . 25.0 111.466 -177.957 . . . . . . . . 1 1 . 1 stop_ save_