data_2k5d_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 2k5d _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 ' 19' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 93.4 mt . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 109.598 -0.519 . . . . 72.51 109.598 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 59.1 mtmt -124.26 134.8 53.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.255 0.55 . . . . 73.43 111.689 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.79 144.36 57.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.404 -0.816 . . . . 73.53 113.012 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 71.7 m -123.55 -62.43 1.31 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.132 -0.485 . . . . 74.33 111.33 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.16 179.68 8.8 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.161 0.505 . . . . 75.13 111.916 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.2 tp -101.94 101.32 11.72 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.485 -0.561 . . . . 73.44 109.485 170.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.489 ' HG2' ' OE1' ' A' ' 58' ' ' GLN . 10.4 tpp180 -58.3 -58.82 6.8 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.225 0.454 . . . . 73.15 112.225 -173.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -169.14 135.21 1.67 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.84 0.353 . . . . 74.11 111.73 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -98.82 98.14 9.27 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 110.006 -0.368 . . . . 70.42 110.006 174.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.49 135.84 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.805 0.336 . . . . 53.41 110.75 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.476 ' HG2' HD12 ' A' ' 41' ' ' ILE . 80.7 mtt180 -116.68 170.25 8.73 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.476 0.655 . . . . 75.45 112.742 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -75.1 113.65 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 115.577 -0.738 . . . . 75.34 111.385 -175.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.506 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -83.56 133.83 34.85 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.934 0.397 . . . . 70.45 111.932 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -80.6 150.25 29.58 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.544 -0.298 . . . . 61.43 110.858 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.22 -34.67 70.66 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.866 0.365 . . . . 65.51 111.97 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.53 -27.62 66.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.302 -0.408 . . . . 74.11 111.975 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.26 -57.52 0.64 Allowed Glycine 0 CA--C 1.524 0.64 0 C-N-CA 120.827 -0.701 . . . . 53.01 113.042 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.1 m -62.96 149.79 43.87 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.428 0.633 . . . . 72.14 112.375 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 39.5 t -90.94 147.55 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.979 -0.555 . . . . 72.32 111.228 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -81.31 174.54 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.574 0.702 . . . . 72.52 112.123 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -88.23 -10.4 49.87 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.535 -0.757 . . . . 72.13 111.225 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 29' ' ' ARG . 21.9 mm-40 -81.89 144.04 31.25 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.125 0.488 . . . . 71.23 111.871 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.476 HD12 ' HG2' ' A' ' 29' ' ' ARG . 20.7 mm -85.08 153.43 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.945 -0.571 . . . . 73.41 112.323 -172.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -113.9 -58.17 2.18 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 116.343 -0.39 . . . . 72.54 110.107 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -141.13 160.46 40.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.051 0.54 . . . . 72.45 110.825 172.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 44' ' ' ARG . 37.7 mtt180 -119.05 117.46 28.82 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.595 0.236 . . . . 75.45 110.899 178.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.0 m -96.2 121.35 37.89 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 111.91 0.337 . . . . 73.2 111.91 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.491 ' HH ' HD12 ' A' ' 61' ' ' ILE . 55.8 m-85 -108.47 153.92 22.64 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.235 0.541 . . . . 75.12 112.021 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -97.0 112.58 24.27 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.757 -0.656 . . . . 74.55 110.716 174.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.647 HD12 HG23 ' A' ' 59' ' ' VAL . 81.4 mt -123.66 137.42 54.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.691 0.282 . . . . 71.53 111.19 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.52 140.46 32.73 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.763 0.316 . . . . 75.2 110.418 174.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 121.131 0.491 . . . . 73.12 111.486 -179.085 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 112.296 0.48 . . . . 73.5 112.296 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.4 ptp -72.92 118.69 16.17 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.234 -0.439 . . . . 72.51 109.983 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.9 pt -94.74 138.08 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-O 120.996 0.426 . . . . 71.41 111.947 -173.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.489 ' OE1' ' HG2' ' A' ' 25' ' ' ARG . 25.2 mm-40 -93.16 104.71 16.88 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.24 -0.436 . . . . 75.55 110.977 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.647 HG23 HD12 ' A' ' 48' ' ' LEU . 81.0 t -98.49 116.16 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-O 120.875 0.369 . . . . 73.23 111.481 -177.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.9 t -111.06 123.93 51.16 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.872 0.368 . . . . 43.11 111.697 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.491 HD12 ' HH ' ' A' ' 46' ' ' TYR . 32.0 pt -115.31 147.06 37.79 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.328 -0.396 . . . . 73.22 110.944 176.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.95 157.61 51.83 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 122.325 2.017 . . . . 73.21 113.698 -177.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.01 -33.27 66.99 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.879 0.696 . . . . 73.22 112.879 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 58.4 m -58.32 -19.42 34.83 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.737 0.303 . . . . 63.04 111.721 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.9 t -91.31 126.07 56.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-N 116.545 -0.298 . . . . 73.22 110.829 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.78 162.1 43.38 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.406 2.07 . . . . 72.23 113.149 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 52.6 tp -72.42 142.33 48.67 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.202 -0.454 . . . . 75.53 111.183 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 105' ' ' ILE . 0.2 OUTLIER -111.02 106.72 15.89 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.259 0.552 . . . . 74.33 111.475 177.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -74.79 74.87 2.1 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.72 -0.673 . . . . 74.11 111.568 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -94.67 154.43 17.33 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.967 0.413 . . . . 71.1 112.009 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.3 170.47 16.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.005 0.431 . . . . 63.45 111.671 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -67.75 129.95 41.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.043 0.449 . . . . 62.34 111.687 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 90.3 m-20 69.42 18.31 7.91 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.604 0.762 . . . . 64.11 113.028 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.38 132.66 52.2 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.193 -0.317 . . . . 73.12 110.958 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.1 mtm180 -76.36 118.67 19.3 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.025 0.44 . . . . 74.01 111.932 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.516 HG11 HD21 ' A' ' 107' ' ' LEU . 34.0 m -124.75 161.38 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.999 -0.546 . . . . 71.52 111.489 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -138.49 147.23 42.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.125 0.488 . . . . 72.21 110.311 171.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.9 mt -97.81 137.49 36.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.308 -0.405 . . . . 74.22 112.035 -173.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.5 mm -63.57 -71.16 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 CA-C-N 116.12 -0.491 . . . . 75.21 111.413 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.451 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 92.4 m-20 -122.75 82.96 48.95 Favored Pre-proline 0 N--CA 1.473 0.694 0 CA-C-O 120.667 0.27 . . . . 70.33 111.438 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -82.43 132.2 6.81 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.977 2.451 . . . . 73.44 113.574 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.5 pt -136.91 125.71 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 120.858 0.361 . . . . 74.4 111.492 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.02 114.11 18.68 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.302 -0.259 . . . . 75.23 110.302 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 121.604 0.716 . . . . 75.43 112.495 -170.489 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 . . . . . 0 CA--C 1.543 0.682 0 CA-C-O 121.253 0.549 . . . . 74.05 112.329 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -107.48 137.85 44.77 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.622 0.725 . . . . 74.51 112.318 -171.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.426 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 52.7 mt -126.68 109.16 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.567 -0.742 . . . . 71.54 110.716 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -82.73 129.2 34.93 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 122.138 -0.351 . . . . 73.54 110.493 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.9 167.39 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.289 0.566 . . . . 61.52 112.355 -174.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 31.3 t70 -86.68 -62.04 1.6 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.763 -0.653 . . . . 64.42 111.235 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -145.59 155.03 42.79 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.127 0.489 . . . . 71.02 111.122 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.429 ' O ' ' NZ ' ' A' ' 68' ' ' LYS . 71.0 mt -111.81 115.07 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 115.734 -0.666 . . . . 74.44 111.577 -178.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.32 172.23 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 120.549 0.214 . . . . 65.25 111.055 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.516 HD21 HG11 ' A' ' 76' ' ' VAL . 96.2 mt -83.15 150.0 26.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 122.284 -0.26 . . . . 74.32 110.892 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.1 m . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 120.762 0.315 . . . . 75.4 111.345 -179.233 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.4 mt . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 120.957 0.408 . . . . 71.24 111.965 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.556 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 11.1 mptt -116.62 115.67 26.14 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.855 0.36 . . . . 74.41 111.506 178.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -66.8 126.77 30.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.231 -0.44 . . . . 72.44 111.154 177.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.544 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 82.0 p -106.83 -63.51 1.27 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.949 0.351 . . . . 72.4 111.949 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.92 176.61 12.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.345 0.593 . . . . 74.51 112.087 -177.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.431 HD23 ' HG3' ' A' ' 27' ' ' GLU . 61.1 tp -83.16 117.81 23.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.985 -0.552 . . . . 75.31 111.101 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -69.07 -66.81 0.53 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.939 0.399 . . . . 75.44 111.363 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -168.25 131.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.061 0.458 . . . . 73.12 111.745 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.431 ' HG3' HD23 ' A' ' 24' ' ' LEU . 47.2 mt-10 -96.8 99.37 10.95 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.315 -0.402 . . . . 64.53 110.058 173.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m -74.34 118.98 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.281 0.562 . . . . 74.34 111.516 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HG2' HG12 ' A' ' 41' ' ' ILE . 96.3 mtt180 -96.54 164.36 12.64 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.443 0.64 . . . . 72.31 112.291 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.88 111.19 13.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 115.793 -0.64 . . . . 71.53 111.041 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 61.6 tt0 -82.75 147.11 28.62 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.053 0.454 . . . . 75.13 111.617 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -90.93 166.94 12.78 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.924 0.392 . . . . 64.23 110.477 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.39 -24.73 57.25 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 122.131 -0.356 . . . . 74.53 111.678 -178.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -80.91 32.27 0.32 Allowed 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 111.965 0.357 . . . . 71.24 111.965 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.45 -48.08 3.75 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 114.182 0.433 . . . . 71.21 114.182 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 m -66.79 145.3 55.65 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.236 0.541 . . . . 74.05 112.428 -177.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.502 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.5 t -96.29 140.65 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.018 -0.537 . . . . 75.32 111.161 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -75.65 171.68 13.9 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.313 0.578 . . . . 71.34 111.293 178.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.3 -18.3 32.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 55.4 110.707 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.38 137.62 57.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.624 -0.716 . . . . 55.12 110.603 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.605 HG12 ' HG2' ' A' ' 29' ' ' ARG . 32.4 mt -104.46 142.57 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 121.179 0.514 . . . . 75.44 111.377 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.55 -57.78 2.38 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.274 -0.421 . . . . 72.33 111.043 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.41 ' HB3' ' OG ' ' A' ' 60' ' ' SER . 61.7 mt-10 -137.46 148.48 46.13 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 120.992 0.425 . . . . 75.21 111.688 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -110.2 111.58 23.0 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.357 -0.383 . . . . 73.14 111.166 176.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.4 m -101.46 124.16 46.69 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.393 0.516 . . . . 72.15 112.393 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.549 ' HH ' HD11 ' A' ' 67' ' ' LEU . 54.2 m-85 -115.83 160.58 19.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.905 0.482 . . . . 72.31 111.045 177.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -101.12 125.61 47.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.714 0.292 . . . . 43.4 111.67 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.527 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -123.52 134.37 53.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-O 120.795 0.331 . . . . 71.21 111.722 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HE2' ' HB3' ' A' ' 22' ' ' SER . 3.8 mptp? -80.77 147.25 30.59 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.98 0.419 . . . . 74.23 111.313 173.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 116.083 -0.508 . . . . 72.42 110.507 174.234 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 55' ' ' ARG . 5.3 ptp180 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 120.975 0.417 . . . . 74.45 111.933 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 43.1 ttm -96.88 110.43 22.94 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.133 -0.485 . . . . 74.11 109.701 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 26.8 pt -95.1 127.97 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 121.026 0.441 . . . . 73.14 111.176 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 77.3 mt-30 -93.65 105.82 17.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.378 0.608 . . . . 71.03 110.656 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.527 HG21 HD12 ' A' ' 48' ' ' LEU . 84.0 t -94.82 122.53 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 115.988 -0.551 . . . . 74.55 111.986 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.708 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 24.5 t -114.35 130.21 56.67 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.968 0.413 . . . . 75.34 111.377 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 pt -120.36 156.2 55.54 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 116.315 -0.402 . . . . 74.0 110.982 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.35 125.75 19.44 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.452 2.101 . . . . 71.33 112.392 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.5 39.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.016 0.747 . . . . 73.41 113.016 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.0 t -56.82 -30.76 64.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.058 0.456 . . . . 54.13 111.519 175.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.4 t -78.75 133.88 61.75 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 116.069 -0.514 . . . . 72.24 111.328 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.49 158.01 4.41 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.379 2.719 . . . . 75.52 114.476 -178.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.549 HD11 ' HH ' ' A' ' 46' ' ' TYR . 58.6 tp -68.14 145.81 54.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.254 -0.885 . . . . 74.11 111.767 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -90.12 126.03 35.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.254 0.549 . . . . 71.45 111.88 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -107.65 25.78 11.09 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.661 -0.7 . . . . 73.25 111.592 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -62.19 153.45 30.3 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.208 0.528 . . . . 75.21 112.087 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -80.97 164.71 22.35 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.894 -0.594 . . . . 65.12 112.267 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -59.12 118.08 5.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.065 -0.516 . . . . 74.4 111.614 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.515 HD21 ' N ' ' A' ' 73' ' ' ASN . 0.8 OUTLIER 68.31 24.25 7.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.55 0.74 . . . . 73.42 112.216 -178.639 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.79 133.92 50.06 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.765 0.317 . . . . 73.53 111.3 176.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.556 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 75.5 mtm180 -74.63 113.49 11.95 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.116 0.484 . . . . 73.44 111.682 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.495 HG11 HD22 ' A' ' 107' ' ' LEU . 35.0 m -126.16 153.99 35.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.284 0.564 . . . . 73.31 111.999 -177.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.4 pt-20 -128.01 154.72 45.31 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.126 -0.488 . . . . 75.44 110.268 173.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.35 146.67 24.54 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.168 0.803 . . . . 74.43 113.168 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.72 112.49 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 115.336 -0.847 . . . . 73.22 110.036 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 58.78 62.01 4.59 Favored Pre-proline 0 CA--C 1.547 0.864 0 N-CA-C 112.023 0.379 . . . . 62.14 112.023 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -81.66 140.45 11.75 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.817 2.345 . . . . 75.1 113.8 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.44 147.23 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-O 120.945 0.402 . . . . 74.42 111.099 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.35 108.16 16.35 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.916 0.389 . . . . 72.03 110.693 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 121.214 0.53 . . . . 62.03 111.564 -174.851 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.244 0.789 0 N-CA-C 114.352 1.241 . . . . 74.13 114.352 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -104.39 120.75 41.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.406 -1.27 . . . . 75.13 111.818 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.499 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 56.4 mt -99.59 107.18 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.219 -0.446 . . . . 74.31 109.968 175.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.708 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 58.7 mtpt -94.06 129.14 40.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.15 0.5 . . . . 73.33 111.942 -175.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.48 174.7 7.62 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.991 0.425 . . . . 71.42 111.467 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.23 -37.05 26.56 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.952 0.406 . . . . 71.2 110.787 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -161.01 164.93 30.6 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 116.316 -0.402 . . . . 73.32 111.502 177.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 44.2 mt -122.56 118.39 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 116.494 -0.321 . . . . 73.35 110.815 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.38 167.13 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 120.793 0.33 . . . . 74.11 111.652 -177.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.495 HD22 HG11 ' A' ' 76' ' ' VAL . 95.0 mt -70.74 144.13 51.03 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.649 0.262 . . . . 71.23 111.123 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.403 ' HA ' ' HG2' ' A' ' 77' ' ' GLU . 57.8 m . . . . . 0 N--CA 1.473 0.689 0 CA-C-O 120.837 0.351 . . . . 64.31 111.881 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 CA--C 1.533 0.321 0 CA-C-O 120.813 0.34 . . . . 75.31 110.174 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 56.9 mtmt -123.71 117.22 24.45 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.258 0.551 . . . . 72.3 111.978 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.7 157.46 9.35 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.948 -1.024 . . . . 74.51 113.03 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.487 ' OG ' ' HE3' ' A' ' 49' ' ' LYS . 33.9 m -134.14 -65.22 0.66 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.208 0.448 . . . . 64.24 112.208 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.52 -179.29 7.53 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.222 0.534 . . . . 70.24 112.307 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.415 HD23 ' HG3' ' A' ' 27' ' ' GLU . 59.0 tp -88.29 120.08 29.32 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.833 -0.621 . . . . 72.51 110.308 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -76.37 -55.31 5.66 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.982 0.42 . . . . 74.42 111.421 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -173.57 131.74 0.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.141 -0.482 . . . . 75.42 111.003 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.415 ' HG3' HD23 ' A' ' 24' ' ' LEU . 37.7 mt-10 -90.83 98.63 11.89 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.721 -0.474 . . . . 60.42 109.721 171.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.4 m -67.27 119.22 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.33 0.586 . . . . 74.44 111.284 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.499 ' HG2' HG12 ' A' ' 41' ' ' ILE . 56.5 mtt180 -98.48 167.91 10.52 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.378 0.609 . . . . 72.22 112.081 -175.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -83.07 100.22 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.842 -0.617 . . . . 74.24 112.041 -172.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.55 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 60.9 tt0 -79.41 120.74 24.26 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.482 -0.326 . . . . 75.34 110.961 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -67.46 153.34 43.91 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.379 0.511 . . . . 75.21 112.379 -174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.02 -32.37 67.89 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.565 0.697 . . . . 71.43 110.702 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.24 -27.77 66.08 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.225 -0.898 . . . . 62.11 112.002 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.55 -42.15 1.52 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 121.383 -0.437 . . . . 73.44 112.737 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -75.85 151.62 37.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.063 0.459 . . . . 74.14 111.702 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.55 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 36.9 t -88.13 136.86 22.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.411 -0.359 . . . . 73.04 111.414 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t -84.83 149.89 25.4 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.765 0.317 . . . . 72.2 110.539 174.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.05 -14.79 61.48 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.131 0.419 . . . . 74.51 112.131 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.28 142.2 58.5 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.936 0.398 . . . . 64.14 111.333 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.499 HG12 ' HG2' ' A' ' 29' ' ' ARG . 43.9 mt -100.58 139.07 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.501 -0.318 . . . . 75.11 110.696 -178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.61 -58.29 2.23 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.776 0.322 . . . . 74.13 111.121 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.42 159.38 42.29 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.135 0.493 . . . . 73.11 111.505 177.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.2 mtt-85 -115.62 116.89 28.89 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.264 -0.425 . . . . 62.52 110.67 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 m -92.49 129.09 38.52 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.655 0.243 . . . . 60.21 111.655 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.459 ' OH ' HD11 ' A' ' 67' ' ' LEU . 49.6 m-85 -116.77 156.52 27.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.679 0.392 . . . . 72.42 111.442 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -100.18 112.78 25.1 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.166 -0.47 . . . . 75.33 111.061 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.2 mt -114.93 149.01 37.93 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 122.292 -0.255 . . . . 74.54 110.788 177.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.691 ' HZ3' ' HB2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -103.83 141.55 35.93 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 122.043 -0.411 . . . . 73.42 111.469 173.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.469 0.486 0 CA-C-N 116.073 -0.512 . . . . 72.23 110.743 176.596 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 112.282 0.475 . . . . 73.44 112.282 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.566 ' SD ' ' N ' ' A' ' 56' ' ' MET . 1.2 mpt? -79.13 157.94 27.84 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.319 0.859 . . . . 73.33 113.319 -173.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.1 pt -142.03 135.02 28.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.01 -0.995 . . . . 73.04 109.586 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.443 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 24.0 mp0 -93.15 104.35 16.55 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.159 0.504 . . . . 72.54 111.574 -178.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 84.7 t -96.94 130.02 46.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 116.378 -0.373 . . . . 74.34 111.419 -177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m -119.15 129.26 54.92 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.682 0.277 . . . . 71.11 111.434 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.404 HG12 ' HE1' ' A' ' 46' ' ' TYR . 25.9 pt -123.23 149.6 57.99 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.584 -0.28 . . . . 74.35 110.575 176.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.73 139.62 39.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.557 2.171 . . . . 73.11 113.226 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.2 -26.32 67.64 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 112.585 0.587 . . . . 73.02 112.585 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.4 t -63.8 -30.28 71.39 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.03 0.443 . . . . 73.3 111.3 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.0 t -72.18 130.41 86.38 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.216 -0.447 . . . . 72.24 110.708 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -43.66 131.88 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 123.175 2.584 . . . . 75.44 114.323 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.459 HD11 ' OH ' ' A' ' 46' ' ' TYR . 62.0 tp -58.37 137.68 57.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.996 -0.547 . . . . 72.31 111.201 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -75.05 125.95 30.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.198 0.523 . . . . 73.33 111.255 177.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -118.01 22.43 12.24 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.849 -0.614 . . . . 65.33 111.384 -175.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.412 ' CE2' ' HG3' ' A' ' 68' ' ' LYS . 26.0 m-85 -69.34 172.29 7.31 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.522 0.564 . . . . 73.33 112.522 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.43 174.93 8.66 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.879 -0.6 . . . . 73.5 111.576 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -74.21 135.66 42.76 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 110.012 -0.366 . . . . 74.2 110.012 176.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.523 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 95.0 m-20 60.56 20.97 10.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.799 0.44 . . . . 74.55 112.105 -174.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.421 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . -68.13 139.9 56.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.926 0.393 . . . . 72.02 111.663 178.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.581 ' HG3' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -68.1 111.13 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.073 -0.512 . . . . 74.21 111.145 179.342 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.9 m -129.41 147.92 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.362 0.601 . . . . 74.25 112.133 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -133.16 151.2 51.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.025 -0.534 . . . . 72.3 110.727 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.408 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -99.95 135.48 41.32 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.301 -0.409 . . . . 74.23 111.768 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.8 mp -67.77 -76.01 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.386 -0.37 . . . . 74.42 111.061 177.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -126.7 85.36 60.8 Favored Pre-proline 0 N--CA 1.472 0.648 0 CA-C-O 120.754 0.312 . . . . 73.45 110.951 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.27 156.19 14.63 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 123.219 2.613 . . . . 73.31 114.469 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.4 pt -142.81 123.11 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.82 -0.627 . . . . 75.54 110.32 171.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.0 126.88 30.87 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.354 -0.216 . . . . 64.15 110.929 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 CA--C 1.538 0.492 0 CA-C-O 121.193 0.52 . . . . 71.31 111.271 -179.433 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 121.984 0.897 . . . . 71.12 113.309 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.443 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 37.6 m-85 -106.57 149.49 27.11 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.861 -1.063 . . . . 74.11 111.683 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.3 mt -130.37 108.02 15.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 116.227 -0.442 . . . . 74.13 110.311 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -77.99 129.25 35.06 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 122.295 -0.253 . . . . 73.31 111.139 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -130.65 151.71 50.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.29 0.478 . . . . 73.0 112.29 -176.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.1 -39.88 93.98 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.18 -0.464 . . . . 63.14 111.436 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -172.39 162.3 5.38 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.207 -0.451 . . . . 73.22 111.092 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.408 HG12 ' CD2' ' A' ' 78' ' ' LEU . 31.2 mt -122.42 117.43 52.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 115.938 -0.573 . . . . 72.53 110.839 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.9 m -122.34 -179.33 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.21 0.204 . . . . 74.2 111.232 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 88.4 mt -77.85 147.55 35.09 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 120.952 0.406 . . . . 74.3 111.943 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 112.358 0.503 . . . . 74.41 112.358 -177.254 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 N--CA 1.469 0.506 0 CA-C-O 121.344 0.592 . . . . 75.31 112.263 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.551 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 47.4 mmtm -123.97 121.86 36.4 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 55.31 111.456 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -66.75 102.04 0.89 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.818 0.342 . . . . 74.2 110.581 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 21.9 t -89.61 -63.59 1.26 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 111.972 0.36 . . . . 74.34 111.972 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.29 -178.52 7.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.288 0.477 . . . . 62.11 112.288 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.6 tp -89.35 118.03 28.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.941 0.4 . . . . 71.44 110.896 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.8 -64.48 1.03 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.958 0.409 . . . . 75.41 111.748 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -164.71 136.85 4.52 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.36 -0.382 . . . . 75.22 111.335 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -97.9 101.46 12.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.803 0.335 . . . . 74.43 110.243 173.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 42' ' ' LYS . 18.3 m -72.2 98.75 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 121.657 0.741 . . . . 73.31 111.327 -178.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' HG12 ' A' ' 41' ' ' ILE . 85.6 mtt-85 -89.64 155.66 19.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.881 -0.6 . . . . 74.33 111.611 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.587 HG12 ' HE3' ' A' ' 42' ' ' LYS . 56.7 mt -68.85 106.66 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.995 -0.548 . . . . 71.34 111.258 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -85.61 123.93 31.58 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.839 0.352 . . . . 73.11 110.925 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -66.35 157.19 32.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.31 -0.405 . . . . 74.22 111.714 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -62.46 -25.84 68.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.077 0.465 . . . . 75.4 110.99 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -63.87 -15.84 59.92 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 116.021 -0.536 . . . . 74.4 111.611 175.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 -18.46 40.91 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.399 -0.364 . . . . 70.03 112.866 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.4 p -77.8 157.49 29.93 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.14 0.495 . . . . 70.43 111.876 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.0 t -102.4 134.85 42.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.459 -0.337 . . . . 73.54 111.28 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.4 t -90.77 155.3 18.89 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.833 0.349 . . . . 62.12 111.701 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.36 -30.51 69.6 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.161 0.505 . . . . 75.24 110.686 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.23 138.91 57.42 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.49 -0.777 . . . . 72.2 111.799 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.613 HG12 ' HG2' ' A' ' 29' ' ' ARG . 53.1 mt -115.9 138.17 47.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.943 0.401 . . . . 73.41 111.983 -175.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.587 ' HE3' HG12 ' A' ' 30' ' ' ILE . 32.8 mmtp -72.67 -57.18 4.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.444 0.64 . . . . 73.44 110.205 171.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.488 ' HB3' ' HA ' ' A' ' 62' ' ' PRO . 8.9 pt-20 -163.92 166.15 21.99 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.489 -0.778 . . . . 63.2 111.563 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.502 HH12 ' HB2' ' A' ' 67' ' ' LEU . 31.2 mtp180 -114.3 118.34 33.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.464 -0.334 . . . . 74.44 111.5 -172.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 21.8 m -92.87 131.04 38.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 111.827 0.306 . . . . 74.52 111.827 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.418 ' HH ' HD12 ' A' ' 61' ' ' ILE . 68.4 m-85 -120.48 143.78 48.35 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.01 0.433 . . . . 71.45 111.88 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -75.12 109.31 8.5 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.927 -0.579 . . . . 64.22 110.496 173.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.452 HD12 HG22 ' A' ' 59' ' ' VAL . 41.0 mt -111.93 131.99 55.03 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.354 0.597 . . . . 75.1 111.808 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.47 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.6 mmtm -96.07 136.42 36.54 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.947 -0.569 . . . . 62.54 110.41 176.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 N--CA 1.476 0.846 0 O-C-N 122.055 -0.403 . . . . 72.33 111.425 178.326 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 . . . . . 0 N--CA 1.471 0.624 0 CA-C-O 121.572 0.701 . . . . 75.4 112.808 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 70.5 mtp -93.14 137.43 32.49 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.245 -0.889 . . . . 73.32 110.725 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 40.0 pt -121.64 138.71 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 120.956 0.407 . . . . 74.44 111.114 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.7 106.41 18.72 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.519 -0.309 . . . . 73.11 111.395 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 95.7 t -105.24 128.76 58.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.441 0.534 . . . . 74.24 112.441 -176.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -113.67 132.5 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.177 -0.465 . . . . 64.4 111.645 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.418 HD12 ' HH ' ' A' ' 46' ' ' TYR . 34.0 pt -110.92 136.38 20.77 Favored Pre-proline 0 N--CA 1.474 0.764 0 CA-C-O 120.522 0.201 . . . . 75.03 111.073 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.488 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 33.3 Cg_endo -62.28 158.44 40.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.752 2.301 . . . . 74.31 113.33 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.99 -16.65 5.15 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.823 0.675 . . . . 73.12 112.823 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -68.86 -10.23 55.84 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.159 0.429 . . . . 45.21 112.159 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -108.82 129.75 23.57 Favored Pre-proline 0 CA--C 1.544 0.716 0 N-CA-C 112.261 0.467 . . . . 72.42 112.261 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -64.74 161.68 34.9 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.742 2.295 . . . . 72.41 113.072 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.502 ' HB2' HH12 ' A' ' 44' ' ' ARG . 62.7 tp -67.93 134.58 51.03 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.056 0.455 . . . . 74.35 112.103 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.474 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.91 108.64 17.02 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.291 -0.413 . . . . 75.33 111.027 174.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.75 78.67 9.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.049 0.452 . . . . 72.35 110.897 176.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -112.86 150.81 31.21 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.96 0.409 . . . . 74.22 111.2 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -77.34 171.16 15.31 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.327 0.584 . . . . 70.12 111.734 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -59.39 124.37 19.8 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.178 0.513 . . . . 73.33 111.917 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.415 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 94.4 m-20 63.36 35.42 12.28 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.731 -0.668 . . . . 65.43 112.135 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.86 137.36 57.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.367 . . . . 74.21 111.803 177.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.551 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 58.3 mtp180 -67.83 97.06 0.62 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.251 -0.431 . . . . 74.43 112.057 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 107' ' ' LEU . 33.9 m -122.04 176.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 121.325 0.583 . . . . 71.04 112.527 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -159.38 179.58 8.83 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.784 -0.644 . . . . 74.52 110.448 175.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.456 HD13 HG22 ' A' ' 59' ' ' VAL . 85.5 mt -115.45 149.44 38.03 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.579 0.585 . . . . 73.32 112.579 -173.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.558 HG21 ' ND2' ' A' ' 80' ' ' ASN . 48.7 mm -83.21 -73.16 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.893 -0.594 . . . . 73.41 111.094 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.558 ' ND2' HG21 ' A' ' 79' ' ' ILE . 51.1 m-80 -121.35 87.11 44.44 Favored Pre-proline 0 N--CA 1.477 0.885 0 O-C-N 122.244 -0.285 . . . . 72.35 111.527 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.01 136.04 9.0 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 122.928 2.419 . . . . 74.35 113.577 175.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 101' ' ' LYS . 35.8 pt -128.65 134.72 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 121.037 0.446 . . . . 71.44 111.399 172.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.56 111.93 15.11 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.45 -0.341 . . . . 61.11 110.11 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 t0 . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 121.123 0.487 . . . . 74.35 111.882 -172.215 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.646 0 N-CA-C 114.192 1.182 . . . . 75.32 114.192 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -103.51 116.62 32.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.231 -0.895 . . . . 75.11 111.902 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 35.7 mt -105.73 104.42 16.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.353 -0.84 . . . . 72.41 110.692 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.505 ' O ' HG12 ' A' ' 82' ' ' ILE . 4.7 mtpm? -86.6 121.83 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 122.106 -0.371 . . . . 73.12 110.204 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.46 161.46 19.55 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.321 0.86 . . . . 71.33 113.321 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 21.5 t70 -63.91 -55.18 24.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.327 -0.851 . . . . 72.55 111.652 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -158.09 159.11 35.92 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.963 0.411 . . . . 74.3 111.364 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.474 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 57.0 mt -116.71 121.7 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.081 -0.509 . . . . 75.53 111.15 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 30.8 m -124.36 -179.13 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.401 -0.363 . . . . 74.44 110.832 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 76' ' ' VAL . 93.9 mt -80.86 151.22 28.77 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.091 -0.381 . . . . 70.51 111.327 177.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 112.259 0.466 . . . . 73.41 112.259 -176.048 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 69.8 mt . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.543 0.211 . . . . 73.22 110.743 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 90.2 mttt -126.66 127.37 45.07 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.094 0.474 . . . . 73.45 112.157 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -67.35 136.06 54.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.88 -0.6 . . . . 74.31 111.532 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.2 p -113.51 -63.51 1.44 Allowed 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.989 -0.445 . . . . 73.0 111.229 174.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.78 -173.95 4.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.077 0.465 . . . . 52.43 111.759 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 60.4 tp -92.7 124.43 36.71 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.469 -0.332 . . . . 75.14 110.764 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 25' ' ' ARG . 4.1 tpp180 -75.84 -58.1 3.48 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.864 0.364 . . . . 74.11 111.942 -177.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -168.55 141.14 2.88 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.024 0.44 . . . . 72.34 111.817 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -101.2 98.36 8.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.714 -0.476 . . . . 75.31 109.714 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 m -70.15 110.8 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.356 0.598 . . . . 74.52 110.209 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.499 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 81.7 mtt180 -100.34 156.32 17.31 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.513 0.56 . . . . 73.41 112.513 -171.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.73 115.43 2.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.733 -0.667 . . . . 71.44 111.844 -174.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -88.67 119.17 28.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.278 -0.419 . . . . 73.45 110.92 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -60.59 159.91 9.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.062 0.458 . . . . 73.14 111.619 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.76 -18.03 52.37 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.098 -0.501 . . . . 71.45 111.905 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -83.36 -0.11 48.35 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.185 0.439 . . . . 70.51 112.185 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -11.22 70.72 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.169 -0.539 . . . . 75.45 113.726 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -86.98 152.19 22.61 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.418 -0.46 . . . . 60.1 111.606 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.4 t -95.04 125.62 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 120.952 0.406 . . . . 70.1 111.455 -178.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -79.73 176.39 9.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.355 0.598 . . . . 54.33 111.973 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -83.68 -23.41 31.73 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.029 -0.532 . . . . 74.31 111.208 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.61 143.7 54.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.895 0.379 . . . . 74.52 111.11 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.499 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.1 mt -101.14 141.56 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 121.045 0.45 . . . . 74.44 112.16 -174.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -82.53 -50.86 8.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.396 0.617 . . . . 74.24 109.903 174.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -165.98 159.94 16.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.426 -0.806 . . . . 53.33 110.982 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.8 mtt180 -107.58 123.59 48.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.073 0.397 . . . . 72.23 112.073 -175.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.5 m -96.24 114.07 25.72 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.739 0.304 . . . . 74.13 111.382 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -101.04 156.16 17.57 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.959 0.409 . . . . 71.5 111.762 178.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.553 ' HB3' ' HZ3' ' A' ' 49' ' ' LYS . 26.8 m-20 -97.65 116.78 30.52 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.033 -0.53 . . . . 72.55 111.827 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.464 HD12 HG21 ' A' ' 59' ' ' VAL . 66.9 mt -118.86 126.77 52.56 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.05 0.453 . . . . 73.13 111.003 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.553 ' HZ3' ' HB3' ' A' ' 47' ' ' ASP . 0.5 OUTLIER -104.74 115.49 30.41 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.978 0.418 . . . . 72.03 111.272 178.603 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.902 0.382 . . . . 65.14 110.805 178.002 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.293 0.568 . . . . 75.43 112.319 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.521 ' HG3' ' HD2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -94.98 133.3 38.89 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.69 -0.686 . . . . 64.12 111.616 178.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.7 pt -126.3 141.53 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 120.636 0.255 . . . . 75.24 111.084 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -105.19 111.36 24.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.032 0.444 . . . . 75.14 110.844 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 92.7 t -101.98 137.59 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.385 -0.37 . . . . 62.43 111.446 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 89.0 p -124.65 128.81 49.43 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.292 0.568 . . . . 65.24 112.048 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.472 HG23 HG13 ' A' ' 105' ' ' ILE . 29.0 pt -118.91 153.92 52.84 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 115.829 -0.623 . . . . 72.11 110.69 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.43 153.28 55.29 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.406 2.071 . . . . 73.12 113.399 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -16.92 60.17 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.152 0.427 . . . . 72.1 112.152 -178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 74.5 p -66.27 -18.8 65.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.841 0.353 . . . . 75.33 111.601 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.37 124.32 53.8 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 116.562 -0.29 . . . . 74.2 111.303 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.37 169.29 18.76 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.0 2.467 . . . . 61.11 114.141 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.0 tp -70.85 128.82 37.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.908 -0.587 . . . . 73.32 111.513 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 105' ' ' ILE . 0.2 OUTLIER -86.41 114.72 23.41 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.262 0.553 . . . . 73.43 112.294 178.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.96 51.91 1.42 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.716 -0.674 . . . . 64.52 111.205 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -76.71 159.03 30.53 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.325 0.584 . . . . 75.11 112.108 -177.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -77.03 148.26 36.29 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.886 -0.597 . . . . 63.0 111.334 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -59.85 119.27 7.38 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.87 0.367 . . . . 74.41 111.521 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.468 HD21 ' N ' ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.99 24.83 3.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.319 0.648 . . . . 72.31 112.387 179.119 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.97 137.3 43.44 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.549 -0.296 . . . . 52.31 110.577 171.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 19' ' ' LEU . 76.2 mtm-85 -66.85 126.62 29.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.75 0.31 . . . . 74.12 111.44 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.528 HG13 HD22 ' A' ' 107' ' ' LEU . 27.1 m -129.13 151.53 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 121.285 0.564 . . . . 72.34 112.328 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.67 157.86 43.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.182 -0.463 . . . . 73.04 110.445 174.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.8 mt -106.02 141.87 36.68 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.093 0.775 . . . . 74.23 113.093 -170.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.517 HG21 ' ND2' ' A' ' 80' ' ' ASN . 38.8 mm -97.22 118.17 43.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.619 -0.718 . . . . 73.34 110.115 174.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.517 ' ND2' HG21 ' A' ' 79' ' ' ILE . 45.4 m-80 61.55 58.33 3.15 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 123.154 0.581 . . . . 71.12 111.962 -173.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -81.82 132.52 7.6 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.753 2.302 . . . . 73.31 113.745 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.1 pt -139.36 142.22 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-O 120.764 0.316 . . . . 74.53 111.241 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.03 123.16 24.67 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.246 -0.284 . . . . 65.22 110.697 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 t0 . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 121.09 0.471 . . . . 62.22 111.057 -175.677 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 114.464 1.283 . . . . 62.42 114.464 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -114.86 144.94 42.74 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.258 -1.337 . . . . 75.21 111.423 -174.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 61.0 mt -129.65 122.1 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.332 -0.395 . . . . 74.52 110.97 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -89.27 149.14 23.2 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 122.081 -0.387 . . . . 75.03 110.702 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.61 161.18 42.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 74.42 111.496 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.87 -30.93 24.05 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.945 0.402 . . . . 71.44 110.986 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.402 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 25.3 t0 -161.19 153.94 20.76 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.399 0.619 . . . . 65.35 112.045 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.472 HG13 HG23 ' A' ' 61' ' ' ILE . 62.0 mt -115.11 114.18 45.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.515 -0.766 . . . . 72.54 111.178 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.2 m -123.89 178.54 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.834 0.349 . . . . 74.3 111.599 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.528 HD22 HG13 ' A' ' 76' ' ' VAL . 98.0 mt -85.12 146.33 27.19 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.785 0.326 . . . . 74.31 111.68 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.805 0.336 . . . . 74.33 111.152 179.403 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.6 mt . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 110.156 -0.313 . . . . 73.4 110.156 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.581 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -118.62 139.94 50.71 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.351 0.5 . . . . 73.25 112.351 -177.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -77.13 142.6 39.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.926 -0.579 . . . . 74.34 111.282 176.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 46.3 t -123.72 -62.69 1.28 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.253 -0.431 . . . . 72.3 111.454 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.63 174.54 15.19 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.127 0.489 . . . . 70.33 111.858 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.8 tp -87.85 113.43 23.5 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.012 -0.54 . . . . 73.53 110.984 177.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 25' ' ' ARG . 11.6 tpp85 -61.44 -58.13 9.44 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.744 0.307 . . . . 71.42 111.443 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -176.71 143.08 0.44 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.413 0.523 . . . . 74.43 112.413 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -101.21 98.27 8.69 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.29 -0.633 . . . . 73.44 109.29 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.522 HG23 ' HB3' ' A' ' 42' ' ' LYS . 30.0 m -77.46 126.6 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 120.898 0.38 . . . . 71.33 111.756 -175.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.562 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.5 mtt180 -96.03 158.26 15.52 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.89 0.376 . . . . 73.15 111.525 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mt -72.3 139.93 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 116.115 -0.493 . . . . 74.23 111.006 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -107.16 122.71 47.04 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.982 -0.449 . . . . 75.32 111.359 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -72.17 167.4 20.39 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.299 0.571 . . . . 72.41 112.22 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.92 -24.75 64.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.969 -0.559 . . . . 74.34 111.592 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -65.15 -14.06 59.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.002 0.429 . . . . 63.51 111.932 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.55 -3.24 83.49 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.13 -0.557 . . . . 74.45 112.535 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -98.3 148.73 23.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.212 0.53 . . . . 74.4 111.764 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.98 141.93 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.889 -0.596 . . . . 72.14 111.599 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -90.51 169.61 10.89 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.073 -0.512 . . . . 74.42 112.205 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -76.73 -26.96 55.22 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.812 -0.631 . . . . 73.14 110.895 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -77.42 146.21 36.7 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.614 0.721 . . . . 73.2 111.93 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.0 mt -99.46 144.83 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.591 -0.731 . . . . 74.43 111.068 -176.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HB3' HG23 ' A' ' 28' ' ' VAL . 27.7 tptp -82.91 -57.62 3.22 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.304 -0.407 . . . . 70.54 111.076 177.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -168.38 160.93 11.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.916 0.388 . . . . 73.33 111.494 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -107.84 125.96 52.08 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.879 0.371 . . . . 75.33 111.912 -175.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -107.45 121.19 44.12 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.183 -0.462 . . . . 70.13 112.145 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.658 ' HH ' HD12 ' A' ' 67' ' ' LEU . 91.9 m-85 -108.64 152.68 24.47 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.688 0.395 . . . . 75.32 111.989 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.64 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 11.9 m-20 -97.63 111.66 23.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.709 0.633 . . . . 73.44 112.709 177.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.1 mt -114.65 128.49 56.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.982 -0.553 . . . . 72.43 110.344 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.64 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 2.4 mptp? -120.29 145.95 46.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.957 0.408 . . . . 75.42 111.592 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p . . . . . 0 N--CA 1.475 0.782 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.859 176.674 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt180 . . . . . 0 N--CA 1.468 0.465 0 CA-C-O 121.163 0.506 . . . . 72.52 111.194 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.9 ptt? -111.37 141.25 45.16 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.077 -0.511 . . . . 72.2 111.516 -176.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.498 HD12 HD11 ' A' ' 100' ' ' ILE . 22.4 pt -133.49 137.32 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.164 -0.471 . . . . 72.03 111.565 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.07 114.09 26.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.784 0.326 . . . . 75.42 110.84 175.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 87.7 t -94.97 119.32 42.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.771 0.319 . . . . 62.54 111.573 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.6 m -108.68 114.76 28.83 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.999 0.428 . . . . 53.13 111.894 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 pt -108.09 154.09 41.41 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.117 -0.492 . . . . 74.3 111.079 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.57 146.78 51.74 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.747 2.298 . . . . 74.41 113.486 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.25 64.72 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.128 0.788 . . . . 73.32 113.128 -175.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 t -68.99 -19.21 64.14 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.998 0.428 . . . . 73.12 111.386 177.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.3 t -87.1 127.08 60.68 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.406 -0.361 . . . . 74.14 110.864 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.5 177.94 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.722 2.281 . . . . 74.53 113.886 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.658 HD12 ' HH ' ' A' ' 46' ' ' TYR . 54.0 tp -79.92 126.51 31.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.794 -0.639 . . . . 74.23 111.894 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -80.61 122.85 27.58 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.2 0.524 . . . . 75.42 111.74 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.31 76.88 1.74 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.129 0.49 . . . . 73.23 111.075 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -90.04 -172.51 3.53 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.134 0.492 . . . . 74.4 112.126 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -118.11 161.6 19.57 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 116.275 -0.42 . . . . 72.44 111.384 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.34 124.39 20.78 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.873 0.368 . . . . 70.33 111.276 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.581 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 41.9 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 112.74 0.645 . . . . 75.2 112.74 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.66 124.91 25.39 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.302 -0.249 . . . . 74.1 110.88 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -63.21 122.48 16.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.052 0.453 . . . . 73.52 111.527 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.463 HG11 HD21 ' A' ' 107' ' ' LEU . 27.6 m -126.14 140.18 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.12 0.486 . . . . 74.4 111.291 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.411 ' OE2' ' HA ' ' A' ' 108' ' ' THR . 12.7 pt-20 -121.75 152.6 39.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.302 0.572 . . . . 75.44 111.126 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.6 mt -101.19 145.39 28.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.884 -0.598 . . . . 63.42 111.378 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.44 HD11 ' N ' ' A' ' 79' ' ' ILE . 1.9 mp -75.48 -70.98 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.561 -0.29 . . . . 74.02 110.664 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -122.81 86.03 50.01 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-O 120.72 0.295 . . . . 75.01 111.477 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.55 150.14 14.77 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.976 2.45 . . . . 73.33 113.502 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.1 pt -140.97 132.36 28.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 73.11 110.637 171.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.96 125.02 28.83 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 116.575 -0.284 . . . . 64.03 110.96 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 . . . . . 0 CA--C 1.539 0.548 0 CA-C-O 121.148 0.499 . . . . 73.41 111.105 -177.998 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 8.8 p-90 . . . . . 0 N--CA 1.473 0.7 0 N-CA-C 113.031 0.752 . . . . 75.23 113.031 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -112.68 140.43 47.45 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.134 0.79 . . . . 65.24 113.134 -172.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 57.2 mt -123.33 113.46 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.209 -0.905 . . . . 75.33 110.39 173.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -84.39 136.22 33.96 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.157 -0.339 . . . . 73.32 110.246 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.94 164.48 30.07 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.263 0.838 . . . . 53.44 113.263 -173.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.54 -66.65 0.63 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.259 -0.882 . . . . 73.51 111.183 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -141.37 162.46 35.43 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.084 0.468 . . . . 74.25 111.572 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 37.4 mt -125.87 121.46 59.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.812 -0.631 . . . . 62.44 110.979 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.1 m -130.99 172.15 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 120.745 0.307 . . . . 73.55 111.55 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.463 HD21 HG11 ' A' ' 76' ' ' VAL . 92.3 mt -76.74 135.82 39.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.602 0.239 . . . . 71.33 111.25 177.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.411 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 6.2 m . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 116.512 -0.313 . . . . 74.33 111.371 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 mt . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.783 0.325 . . . . 73.43 110.987 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 61.1 mttp -114.31 118.17 33.16 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.093 0.473 . . . . 75.14 112.082 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.39 115.07 13.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.029 -0.532 . . . . 72.33 111.391 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.2 p -99.25 -60.87 1.45 Allowed 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.075 0.398 . . . . 63.1 112.075 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.25 177.88 10.57 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.863 0.69 . . . . 65.54 112.863 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.3 tp -81.98 119.52 24.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.477 -0.783 . . . . 75.2 110.604 173.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 8.5 tpt180 -74.89 -55.76 5.46 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.064 0.394 . . . . 73.5 112.064 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -170.67 143.1 2.11 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.897 0.332 . . . . 74.14 111.897 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -110.49 118.96 37.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.747 0.308 . . . . 75.4 110.588 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.9 m -96.73 117.71 41.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 121.021 0.439 . . . . 70.1 110.619 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.603 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 78.5 mtt180 -91.76 179.52 5.61 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.363 0.601 . . . . 75.22 112.511 -175.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.0 mt -97.83 114.22 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.633 -0.712 . . . . 75.12 110.989 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.539 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.3 tt0 -81.28 130.2 34.93 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.284 0.564 . . . . 73.22 111.527 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.434 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.4 m-20 -80.63 145.78 31.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.792 -0.64 . . . . 74.01 110.682 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -63.36 -18.12 63.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.118 0.485 . . . . 73.33 111.166 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.35 -17.91 63.09 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.937 -0.574 . . . . 73.22 111.703 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.01 -49.15 0.89 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.379 -0.439 . . . . 63.31 113.175 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.5 m -74.45 155.92 37.52 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.067 0.461 . . . . 75.41 111.638 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 40.4 t -96.39 124.33 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.489 -0.323 . . . . 75.42 111.314 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.434 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 47.8 t -59.68 164.46 3.62 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.809 0.67 . . . . 72.24 112.809 -177.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.603 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 10.2 m-20 -81.56 -2.72 51.02 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.963 -0.562 . . . . 74.02 110.659 171.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.85 124.84 27.59 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.057 -0.52 . . . . 74.1 109.949 170.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 48.9 mt -95.46 140.88 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.748 0.309 . . . . 73.53 110.854 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -87.27 -59.55 2.22 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.724 0.297 . . . . 70.21 110.963 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.44 ' CD ' ' HZ1' ' A' ' 101' ' ' LYS . 37.0 mt-10 -137.64 161.05 37.5 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.402 0.62 . . . . 74.42 111.772 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -132.61 111.24 11.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.68 -0.691 . . . . 65.35 110.856 -177.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 31.0 m -95.14 131.65 40.92 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.409 0.522 . . . . 74.23 112.409 -175.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -113.33 152.2 30.22 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.772 0.429 . . . . 72.33 111.444 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.512 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 48.8 m-20 -88.11 110.11 20.4 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.283 -0.417 . . . . 73.31 111.217 174.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.618 HD12 HG23 ' A' ' 59' ' ' VAL . 41.2 mt -114.53 130.63 56.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.993 0.425 . . . . 72.34 110.847 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -87.29 118.03 26.44 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.83 0.348 . . . . 74.34 110.832 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.323 0.582 . . . . 73.34 112.399 -176.492 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 120.974 0.416 . . . . 74.45 111.696 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -70.07 132.75 46.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.038 -0.528 . . . . 75.11 109.815 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.437 HG13 ' HB2' ' A' ' 48' ' ' LEU . 34.0 pt -103.48 118.11 50.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.126 0.489 . . . . 71.0 110.838 177.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -87.4 104.33 16.34 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.097 0.475 . . . . 74.42 109.741 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.618 HG23 HD12 ' A' ' 48' ' ' LEU . 90.3 t -94.39 119.74 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-O 121.105 0.479 . . . . 74.31 112.25 -172.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.2 m -106.7 121.97 45.41 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.994 -0.548 . . . . 73.05 111.29 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.445 HG22 HG13 ' A' ' 105' ' ' ILE . 36.9 pt -119.33 145.91 39.68 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 116.657 -0.247 . . . . 71.21 110.62 174.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.47 134.64 64.8 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.113 1.875 . . . . 75.21 112.261 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.76 -7.17 6.99 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.805 0.669 . . . . 65.25 112.805 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.5 p -70.46 -20.06 62.91 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 120.719 0.295 . . . . 54.53 110.883 173.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.5 t -82.1 133.47 51.07 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.981 -0.554 . . . . 65.21 110.747 175.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.64 151.19 7.9 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.14 2.56 . . . . 72.03 114.421 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 68.2 tp -63.96 136.34 57.26 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.926 -0.579 . . . . 73.32 112.197 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -92.52 125.21 37.06 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.15 0.5 . . . . 74.43 111.339 175.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -113.29 72.01 0.76 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.923 -0.58 . . . . 74.51 111.007 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -102.87 170.32 8.06 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.412 0.625 . . . . 75.23 111.856 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.6 168.34 10.59 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.54 -0.755 . . . . 74.31 111.496 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.23 130.68 44.05 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.912 0.387 . . . . 75.31 111.851 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.408 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 96.3 m-20 62.12 21.98 12.8 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.225 0.61 . . . . 71.31 112.222 -177.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.16 127.95 34.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.621 0.248 . . . . 70.12 111.038 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -62.05 116.26 4.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.125 0.488 . . . . 75.24 111.593 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.503 HG11 HD21 ' A' ' 107' ' ' LEU . 29.5 m -129.09 152.87 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.073 -0.512 . . . . 73.33 111.888 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.08 152.55 50.98 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.086 0.469 . . . . 74.43 110.461 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.0 mt -98.19 144.96 27.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.167 0.803 . . . . 75.24 113.167 -170.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.6 mm -92.37 113.51 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.378 -0.828 . . . . 75.44 110.31 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 48.3 67.69 4.25 Favored Pre-proline 0 N--CA 1.48 1.041 0 N-CA-C 112.776 0.658 . . . . 71.24 112.776 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.49 146.27 15.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.869 2.379 . . . . 71.42 113.429 177.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 46.8 pt -136.81 140.95 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 122.659 0.384 . . . . 72.52 111.002 176.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.35 124.9 25.31 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.188 -0.32 . . . . 73.3 110.709 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.5 t0 . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 121.469 0.652 . . . . 50.13 111.25 -175.438 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.42 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 122.309 1.052 . . . . 75.53 113.681 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -107.08 148.38 28.85 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.741 -1.118 . . . . 65.4 111.237 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 38.2 mt -123.53 113.54 37.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 110.052 -0.351 . . . . 75.21 110.052 174.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.44 ' HZ1' ' CD ' ' A' ' 43' ' ' GLU . 24.9 mtpp -85.35 132.64 34.21 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 122.224 -0.297 . . . . 72.4 110.691 -177.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -127.13 151.14 49.05 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.335 0.494 . . . . 72.53 112.335 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.16 -31.29 67.51 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.066 -0.515 . . . . 71.54 110.777 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -167.03 161.26 14.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.015 -0.539 . . . . 75.23 111.413 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.445 HG13 HG22 ' A' ' 61' ' ' ILE . 42.2 mt -122.83 116.71 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.356 -0.384 . . . . 75.31 111.174 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.2 m -124.35 171.32 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.903 0.383 . . . . 73.02 111.478 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.503 HD21 HG11 ' A' ' 76' ' ' VAL . 97.5 mt -75.62 145.34 41.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.479 -0.328 . . . . 74.05 110.809 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.536 0.439 0 CA-C-O 120.663 0.268 . . . . 63.54 110.974 177.2 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 92.1 mt . . . . . 0 CA--C 1.535 0.377 0 CA-C-O 120.848 0.356 . . . . 75.42 110.643 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.499 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 7.1 mtmp? -136.21 140.82 43.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.52 -0.309 . . . . 73.23 111.305 -176.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -65.4 135.48 55.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.095 0.406 . . . . 73.14 112.095 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.0 m -116.14 -63.96 1.38 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.835 0.35 . . . . 73.01 111.428 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.26 -173.68 4.15 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.043 0.449 . . . . 72.4 111.747 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.6 tp -102.09 127.24 49.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.393 -0.367 . . . . 61.52 110.177 171.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -79.63 -68.47 0.66 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.969 0.414 . . . . 75.4 111.951 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -163.42 145.6 9.8 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.275 0.472 . . . . 71.55 112.275 -171.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -106.67 103.1 12.46 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.286 -0.416 . . . . 63.32 110.911 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 m -76.6 109.98 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.344 0.592 . . . . 63.32 111.172 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 70.0 mtp180 -92.67 170.43 9.72 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.2 -0.455 . . . . 70.25 111.957 -174.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.41 ' HB ' ' HB3' ' A' ' 38' ' ' SER . 48.6 mt -80.82 144.18 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.484 -0.325 . . . . 74.54 111.1 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -110.48 133.25 53.46 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.767 0.318 . . . . 64.45 111.028 176.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.5 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.6 m-20 -79.68 162.43 25.23 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.49 0.552 . . . . 74.03 112.49 -175.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.89 -38.71 67.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.73 -0.668 . . . . 70.12 110.869 174.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.25 -37.44 67.22 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.534 -0.757 . . . . 73.41 111.539 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.25 -32.18 4.99 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 116.061 -0.518 . . . . 60.31 111.952 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 54.8 m -62.7 166.54 5.33 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.055 0.455 . . . . 75.12 111.737 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.31 146.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.933 0.397 . . . . 73.14 111.507 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.5 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 32.7 t -94.65 156.62 16.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.093 0.473 . . . . 72.44 111.508 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.432 ' HA ' ' NH2' ' A' ' 29' ' ' ARG . 13.5 t70 -67.06 -31.56 72.15 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.177 -0.465 . . . . 73.22 111.043 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.401 ' HB2' HD11 ' A' ' 30' ' ' ILE . 16.9 mm-40 -73.45 152.53 40.73 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.434 0.635 . . . . 73.51 112.008 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 56.9 mt -114.56 147.17 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.972 -0.558 . . . . 74.14 111.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.57 -60.51 2.23 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.064 0.459 . . . . 73.11 111.411 176.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -147.04 167.44 24.06 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.105 -0.498 . . . . 73.35 111.019 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -128.93 118.21 22.26 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.243 -0.435 . . . . 73.04 110.739 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.2 m -95.76 124.97 40.02 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.385 0.513 . . . . 72.32 112.385 -175.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -106.4 167.87 9.54 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.086 0.47 . . . . 72.53 111.568 177.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -112.38 116.15 29.87 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.78 -0.646 . . . . 74.25 111.031 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.3 mt -121.6 121.06 36.57 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 73.21 111.238 178.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 56' ' ' MET . 20.2 ptmt -96.45 128.47 43.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.395 0.617 . . . . 73.43 111.603 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 121.175 0.512 . . . . 74.44 111.893 -177.354 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 . . . . . 0 N--CA 1.47 0.564 0 CA-C-O 121.097 0.475 . . . . 74.41 111.582 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.488 ' HA ' ' HA ' ' A' ' 49' ' ' LYS . 22.8 ptp -105.45 144.11 32.68 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.903 -0.59 . . . . 74.22 111.441 176.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.51 HD12 HD11 ' A' ' 100' ' ' ILE . 24.0 pt -106.06 144.62 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 116.103 -0.499 . . . . 74.33 110.598 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -87.74 105.43 17.38 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.836 0.35 . . . . 62.53 111.017 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -101.1 119.62 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 N-CA-C 112.218 0.451 . . . . 75.03 112.218 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.538 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 39.2 m -106.79 129.13 54.7 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.989 0.423 . . . . 43.13 111.623 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.9 pt -126.7 149.85 69.52 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 116.508 -0.315 . . . . 64.41 110.645 174.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -55.69 141.82 83.54 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.486 2.124 . . . . 74.42 112.843 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.27 -18.13 34.74 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.59 0.589 . . . . 65.23 112.59 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 45.1 t -62.38 -27.95 69.43 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.851 0.358 . . . . 74.12 111.484 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.7 t -77.08 128.58 80.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 116.512 -0.313 . . . . 73.25 111.034 178.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 155.42 33.45 Favored 'Trans proline' 0 CA--C 1.544 1.008 0 C-N-CA 122.797 2.331 . . . . 72.25 113.667 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.53 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 26.7 tp -67.89 134.42 50.82 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.095 -0.502 . . . . 71.13 111.749 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.413 ' H ' HD12 ' A' ' 67' ' ' LEU . 61.1 mmtt -83.74 -70.99 0.53 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.844 0.683 . . . . 74.33 112.844 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 50.6 mt-10 55.6 49.85 15.68 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 120.702 0.287 . . . . 71.43 111.608 -175.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -66.65 169.56 7.6 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.119 0.485 . . . . 75.23 112.072 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.53 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 3.9 m-20 -60.66 138.3 58.09 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.994 -0.548 . . . . 74.22 111.061 176.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -62.68 125.31 23.51 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 116.389 -0.369 . . . . 71.01 111.615 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 69.32 17.63 8.18 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.593 0.757 . . . . 70.21 112.914 -176.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.53 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -80.21 146.33 31.79 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.991 -0.443 . . . . 71.21 111.265 175.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.462 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 75.4 mtt180 -69.99 114.81 8.52 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.046 0.45 . . . . 74.43 111.681 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.526 HG13 HD23 ' A' ' 107' ' ' LEU . 27.4 m -126.93 140.42 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.075 -0.511 . . . . 74.33 111.146 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.7 pt-20 -121.66 155.9 34.16 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.242 0.544 . . . . 74.43 111.331 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -98.86 122.14 41.72 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.373 0.509 . . . . 72.5 112.373 -174.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -72.5 108.53 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 115.956 -0.565 . . . . 74.21 110.331 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 55.57 67.02 3.27 Favored Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 112.817 0.673 . . . . 74.11 112.817 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.87 137.7 10.03 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.778 2.318 . . . . 74.52 113.633 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 101' ' ' LYS . 40.1 pt -120.59 141.95 38.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 121.029 0.442 . . . . 74.0 110.995 174.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.72 129.0 36.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.611 -0.268 . . . . 73.45 110.468 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.1 t0 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 121.277 0.56 . . . . 74.22 111.998 -174.825 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.805 0 N-CA-C 113.754 1.02 . . . . 75.45 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -107.32 143.92 34.91 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.828 -1.078 . . . . 74.34 111.614 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.51 HD11 HD12 ' A' ' 57' ' ' ILE . 63.2 mt -131.87 131.68 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.976 -0.556 . . . . 72.44 110.315 176.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.538 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 32.9 mtmm -109.14 126.03 52.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.761 0.315 . . . . 75.1 111.228 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.76 162.95 16.88 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.5 0.556 . . . . 72.45 112.5 -173.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -73.27 -29.15 62.54 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.583 -0.735 . . . . 73.44 110.542 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -174.45 162.63 3.53 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.995 -0.548 . . . . 74.32 111.266 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 34.2 mt -118.98 119.92 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.44 -0.345 . . . . 71.53 110.665 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.72 174.13 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-O 120.905 0.384 . . . . 74.22 111.834 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.526 HD23 HG13 ' A' ' 76' ' ' VAL . 95.0 mt -77.53 132.29 38.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.66 -0.246 . . . . 74.33 111.023 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.462 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 87.6 m . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 112.108 0.41 . . . . 73.34 112.108 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.8 mt . . . . . 0 CA--C 1.532 0.255 0 CA-C-O 120.732 0.301 . . . . 74.23 110.189 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HB3' ' HZ1' ' A' ' 20' ' ' LYS . 9.0 mtpm? -101.63 120.88 41.02 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.129 0.49 . . . . 75.45 111.729 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 35.7 t80 -59.34 115.21 3.09 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.454 -0.793 . . . . 74.54 110.371 173.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.461 ' OG ' ' HG2' ' A' ' 49' ' ' LYS . 49.7 m -98.69 -64.42 1.04 Allowed 'General case' 0 N--CA 1.474 0.735 0 O-C-N 122.12 -0.362 . . . . 72.41 111.958 -178.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.28 176.96 11.12 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.287 0.565 . . . . 74.31 112.257 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.3 tp -91.25 107.32 19.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.809 -0.632 . . . . 73.32 110.513 175.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -61.66 -59.2 5.55 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.43 -0.35 . . . . 75.51 111.7 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -173.26 130.51 0.47 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.508 0.559 . . . . 74.41 112.508 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -98.58 99.54 10.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.99 -0.55 . . . . 73.42 110.102 171.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 m -77.71 115.54 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.027 0.442 . . . . 70.54 111.285 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 78.8 mtt85 -87.29 168.45 13.18 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.265 0.555 . . . . 74.42 112.153 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.3 mt -79.4 122.15 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 74.44 111.786 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.441 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -91.94 112.59 24.58 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.9 0.381 . . . . 73.21 111.035 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -59.17 162.88 4.1 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.64 0.608 . . . . 65.12 112.64 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.35 -32.7 57.46 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 116.171 -0.468 . . . . 70.3 111.345 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.14 -7.26 22.05 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.493 0.553 . . . . 54.3 112.493 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 93.33 -10.28 73.42 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.234 -0.508 . . . . 73.24 113.27 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -93.4 145.41 24.5 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.39 -0.476 . . . . 63.3 111.518 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 28.9 t -75.49 151.72 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.525 -0.307 . . . . 74.54 111.521 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -105.1 170.99 7.56 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.09 0.471 . . . . 72.4 111.679 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.26 -28.25 64.02 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.993 -0.549 . . . . 75.34 110.945 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -74.96 146.15 41.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.313 0.577 . . . . 74.22 112.225 -177.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 51.3 mt -99.0 153.63 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 115.655 -0.702 . . . . 74.54 111.348 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.438 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 24.0 tptm -108.83 -58.64 1.99 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.859 0.362 . . . . 74.04 111.359 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.6 mt-10 -136.33 139.97 42.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.057 0.456 . . . . 72.53 111.286 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -107.53 112.43 25.19 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 116.347 -0.388 . . . . 74.31 111.203 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.6 m -103.64 122.23 44.58 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.702 0.63 . . . . 72.23 112.702 -177.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -105.83 161.16 14.67 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.341 0.656 . . . . 75.32 111.574 175.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -108.41 116.23 31.58 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.321 -0.4 . . . . 74.43 110.899 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.633 HD12 HG21 ' A' ' 59' ' ' VAL . 65.5 mt -113.12 144.4 42.7 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.699 0.285 . . . . 74.44 110.747 176.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG2' ' OG ' ' A' ' 22' ' ' SER . 14.7 mmmm -102.4 126.13 49.33 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.779 0.324 . . . . 72.42 111.314 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 74.23 111.608 178.336 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 . . . . . 0 CA--C 1.537 0.444 0 CA-C-O 120.7 0.286 . . . . 74.41 111.099 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.9 ptp -95.11 114.18 25.95 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 121.121 0.486 . . . . 74.11 112.218 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.513 HD11 HD12 ' A' ' 100' ' ' ILE . 28.9 pt -99.01 135.67 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.307 -0.406 . . . . 75.51 110.654 175.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.0 mp0 -87.05 104.28 16.17 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.933 0.397 . . . . 71.44 110.637 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.633 HG21 HD12 ' A' ' 48' ' ' LEU . 91.9 t -94.94 114.23 31.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.954 0.407 . . . . 74.11 111.423 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.457 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 29.5 t -107.52 131.49 54.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.098 0.475 . . . . 75.11 111.693 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.9 pt -123.51 147.86 54.02 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 115.947 -0.57 . . . . 74.45 111.313 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -53.27 151.4 22.63 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.999 2.466 . . . . 73.24 113.911 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.02 -47.65 61.61 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.664 0.987 . . . . 75.11 113.664 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.5 m -70.49 -4.12 21.22 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.906 0.706 . . . . 75.03 112.906 -174.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.25 119.84 77.71 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 120.581 0.229 . . . . 75.33 110.496 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.18 142.94 44.02 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.942 2.428 . . . . 61.23 113.693 -176.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.99 128.58 36.18 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.041 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -79.35 -63.7 1.36 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.407 0.521 . . . . 73.14 112.407 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 58.64 48.97 10.95 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 112.625 0.602 . . . . 72.51 112.625 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -75.99 -166.01 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.054 0.454 . . . . 75.23 112.071 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -91.48 158.74 16.31 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.406 0.521 . . . . 73.34 112.406 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.6 t80 -60.12 -22.1 62.4 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.891 0.701 . . . . 74.22 112.891 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.421 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 15.3 m120 -114.54 20.88 15.02 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.883 -0.511 . . . . 74.22 111.308 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.63 117.61 20.7 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.865 0.364 . . . . 63.4 111.734 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -73.53 111.28 8.52 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.282 -0.417 . . . . 75.34 111.008 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.512 HG13 HD23 ' A' ' 107' ' ' LEU . 34.6 m -117.41 159.32 17.63 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.286 0.565 . . . . 52.3 112.401 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -135.85 152.55 51.17 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.217 -0.447 . . . . 65.05 110.979 173.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.5 mt -100.73 138.54 37.64 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.552 0.575 . . . . 61.21 112.552 -173.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.21 111.54 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.883 -0.598 . . . . 75.14 110.698 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 47.04 70.26 2.19 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.958 0.725 . . . . 61.43 112.958 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.33 151.95 17.91 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.982 2.455 . . . . 64.45 113.668 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 pt -141.1 139.99 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.22 -0.446 . . . . 73.42 111.054 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -89.24 102.71 15.37 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.675 0.274 . . . . 73.24 111.021 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t70 . . . . . 0 CA--C 1.55 0.952 0 CA-C-O 121.006 0.431 . . . . 75.34 111.54 -174.147 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 113.787 1.032 . . . . 74.35 113.787 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 34.7 m-85 -115.65 129.11 56.37 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.726 -1.124 . . . . 75.02 112.793 -174.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 55.7 mt -104.14 108.02 23.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.998 -0.546 . . . . 75.53 109.728 169.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 52.0 mtpt -93.48 138.49 31.72 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.501 -0.318 . . . . 75.23 111.464 -174.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.31 171.86 13.86 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.546 0.572 . . . . 62.44 112.546 -175.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 -42.55 40.71 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.712 -0.676 . . . . 74.41 111.252 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -163.95 158.62 19.89 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.164 -0.471 . . . . 74.31 111.07 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.534 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 42.1 mt -116.57 115.84 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 116.53 -0.305 . . . . 75.43 110.936 -179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.91 179.08 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 120.838 0.351 . . . . 72.33 111.314 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG13 ' A' ' 76' ' ' VAL . 97.9 mt -86.31 142.21 28.68 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.687 0.28 . . . . 74.23 110.889 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.389 . . . . 74.41 110.975 -179.727 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.1 mt . . . . . 0 N--CA 1.465 0.283 0 N-CA-C 109.608 -0.515 . . . . 74.34 109.608 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 mtpt -101.66 115.71 31.12 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.155 0.503 . . . . 75.23 110.802 -174.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.439 ' HA ' ' CD2' ' A' ' 48' ' ' LEU . 51.6 t80 -60.17 143.77 51.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.408 -0.814 . . . . 74.04 112.536 -174.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 34.3 t -121.3 -66.39 1.05 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.851 0.315 . . . . 62.3 111.851 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.91 178.01 9.29 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.027 0.441 . . . . 54.1 112.181 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.438 HD22 HD13 ' A' ' 67' ' ' LEU . 58.6 tp -94.6 107.46 19.45 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.795 -0.446 . . . . 73.44 109.795 170.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.23 -60.29 3.15 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.277 0.473 . . . . 74.42 112.277 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -165.86 138.08 4.01 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.161 0.43 . . . . 74.24 112.161 -175.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -96.51 101.83 13.52 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.284 -0.416 . . . . 71.11 110.079 172.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.3 m -69.83 125.92 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.118 0.485 . . . . 73.54 111.234 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 29' ' ' ARG . 65.2 mtt85 -104.88 151.97 23.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.433 0.635 . . . . 73.5 112.373 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -66.81 122.03 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.083 -0.962 . . . . 74.34 112.438 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -99.27 132.82 44.33 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.425 -0.352 . . . . 72.34 111.048 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -86.11 169.66 12.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.498 0.555 . . . . 74.24 112.498 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -59.12 -35.79 74.06 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.559 -0.746 . . . . 73.13 111.499 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -60.49 -28.46 68.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.104 -0.498 . . . . 64.52 112.015 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.73 -29.67 7.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 121.177 -0.535 . . . . 63.32 112.368 -174.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.9 m -65.18 143.29 57.95 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.07 0.462 . . . . 74.23 111.62 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.79 135.48 35.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.057 0.456 . . . . 75.01 111.763 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.3 t -82.53 158.08 23.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.828 -0.624 . . . . 73.34 111.506 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -74.43 -8.13 55.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.135 0.493 . . . . 62.44 110.835 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.09 132.45 43.32 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.865 -0.607 . . . . 71.01 110.893 175.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.7 mt -97.99 148.6 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 120.835 0.35 . . . . 74.15 111.497 -175.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -102.73 -57.44 2.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.75 0.309 . . . . 74.04 111.068 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.02 151.97 44.5 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.884 0.373 . . . . 74.35 111.218 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -116.67 117.14 28.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.231 0.539 . . . . 74.32 111.27 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.1 m -91.48 123.52 34.96 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 73.42 112.584 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.495 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.5 m-85 -104.36 148.03 26.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.036 0.534 . . . . 74.24 110.943 174.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -94.5 120.9 35.44 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.839 0.352 . . . . 75.54 110.867 174.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.54 HD12 HG23 ' A' ' 59' ' ' VAL . 63.4 mt -123.55 145.72 48.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.708 0.289 . . . . 75.24 110.821 177.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.557 ' HE2' ' HB2' ' A' ' 22' ' ' SER . 0.0 OUTLIER -112.3 141.64 45.78 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.989 0.424 . . . . 65.15 111.007 174.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 73.23 111.822 -177.896 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 120.911 0.386 . . . . 75.12 111.543 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptm -95.39 148.26 22.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.516 0.675 . . . . 74.5 111.892 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.533 HD13 HD11 ' A' ' 100' ' ' ILE . 22.5 pt -130.78 150.88 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 115.414 -0.812 . . . . 72.53 109.759 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -107.01 105.35 15.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.205 -0.998 . . . . 71.35 111.32 177.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.54 HG23 HD12 ' A' ' 48' ' ' LEU . 84.7 t -94.72 121.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.307 -0.406 . . . . 75.54 111.303 -177.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.532 ' OG ' ' HG2' ' A' ' 101' ' ' LYS . 91.3 p -113.63 131.75 56.02 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.418 0.628 . . . . 72.05 111.503 -178.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.9 pt -122.86 145.4 45.43 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.724 -0.671 . . . . 72.11 110.302 175.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.82 147.74 17.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.45 2.1 . . . . 75.53 113.231 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.2 -22.71 63.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.882 0.372 . . . . 64.13 111.701 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 57.5 p -65.51 -21.38 66.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.305 -0.407 . . . . 74.12 111.742 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.3 t -85.54 124.5 71.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-N 116.562 -0.29 . . . . 74.43 110.939 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.92 159.45 7.22 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.161 2.574 . . . . 72.43 114.617 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.527 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 45.2 tp -75.4 128.42 35.33 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.981 -0.554 . . . . 74.13 111.186 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.451 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.92 -64.26 1.2 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.942 0.719 . . . . 74.01 112.942 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.527 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.7 mt-10 57.02 52.66 8.9 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.843 0.683 . . . . 72.42 112.843 -178.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.48 173.0 9.45 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.006 -0.434 . . . . 75.43 111.464 173.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.16 160.57 31.85 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.974 0.416 . . . . 74.44 111.845 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -71.2 134.46 46.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.941 -0.392 . . . . 73.41 109.941 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 68.52 12.66 8.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.983 0.513 . . . . 75.35 112.153 -175.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.49 136.96 54.0 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.88 0.372 . . . . 71.3 111.576 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -78.27 104.59 8.95 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.439 -0.346 . . . . 74.31 110.873 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.512 HG11 HD23 ' A' ' 107' ' ' LEU . 32.5 m -124.62 154.62 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 121.311 0.577 . . . . 62.54 111.955 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -130.01 155.69 45.7 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.26 0.552 . . . . 73.22 110.866 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.2 mt -103.04 139.28 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.529 0.68 . . . . 75.14 112.421 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.6 mm -85.06 106.66 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.581 -0.736 . . . . 73.13 110.518 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 54.6 68.57 2.57 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.335 0.494 . . . . 73.02 112.335 -176.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.04 130.8 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.724 2.282 . . . . 72.52 113.452 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 pt -124.91 142.97 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.734 0.302 . . . . 75.31 111.317 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.66 115.78 26.44 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.6 0.238 . . . . 73.21 110.914 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 121.168 0.509 . . . . 71.43 111.226 -179.655 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.521 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.259 1.562 0 CA-C-O 122.84 1.305 . . . . 74.34 114.275 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.672 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 80.1 m-85 -84.86 112.81 20.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 113.377 -1.738 . . . . 75.03 110.418 169.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.533 HD11 HD13 ' A' ' 57' ' ' ILE . 30.4 mt -90.43 104.34 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.3 0.571 . . . . 74.31 109.698 177.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.532 ' HG2' ' OG ' ' A' ' 60' ' ' SER . 96.5 mttt -85.21 131.5 34.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 65.34 111.618 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.93 155.62 45.76 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.177 0.513 . . . . 73.5 112.194 -177.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -68.83 -39.14 80.14 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.753 -0.658 . . . . 65.13 110.94 176.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -164.31 162.09 22.19 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.029 -0.532 . . . . 74.1 111.422 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.451 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 39.9 mt -118.75 115.93 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.363 -0.38 . . . . 74.22 111.077 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -125.01 170.52 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-O 120.743 0.306 . . . . 73.21 111.682 -178.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG11 ' A' ' 76' ' ' VAL . 95.2 mt -72.15 139.09 48.12 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 75.31 110.921 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.47 0.538 0 CA-C-N 116.605 -0.271 . . . . 74.11 111.722 179.639 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 70.0 mt . . . . . 0 CA--C 1.533 0.326 0 CA-C-O 121.209 0.528 . . . . 72.44 111.278 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.691 ' HG2' ' HA ' ' A' ' 73' ' ' ASN . 0.2 OUTLIER -158.49 133.31 8.31 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.002 0.43 . . . . 74.43 111.894 -179.606 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.461 ' HA ' HD23 ' A' ' 48' ' ' LEU . 36.1 t80 -72.74 143.99 47.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.118 -0.492 . . . . 75.35 111.566 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 t -125.03 -65.39 1.03 Allowed 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.348 -0.22 . . . . 64.24 111.413 174.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.16 -173.84 4.06 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.916 0.388 . . . . 64.31 112.039 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.4 tp -94.94 133.08 39.08 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.806 0.336 . . . . 74.45 111.134 174.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -88.29 -65.06 1.06 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.837 0.351 . . . . 75.1 111.836 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -164.32 142.93 7.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.846 0.355 . . . . 70.12 111.698 -176.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -106.59 98.98 8.59 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.871 -0.418 . . . . 75.32 109.871 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.42 ' O ' HG23 ' A' ' 28' ' ' VAL . 28.8 m -71.8 92.3 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 121.864 0.84 . . . . 74.32 111.352 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 41' ' ' ILE . 71.5 mtt180 -83.34 159.45 21.86 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.583 -0.735 . . . . 74.42 112.344 -177.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.9 mt -81.01 132.93 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.56 -0.745 . . . . 74.41 110.911 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -110.57 128.17 55.54 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.837 0.351 . . . . 75.14 110.536 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -67.79 153.39 43.82 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.638 0.606 . . . . 72.42 112.638 -173.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.95 -36.94 60.58 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.281 0.563 . . . . 55.25 110.742 172.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -51.05 -42.65 60.66 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.377 -0.829 . . . . 61.15 111.617 175.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.95 -39.98 1.64 Allowed Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.367 -0.444 . . . . 64.43 112.55 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.5 m -68.98 148.27 50.38 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.183 0.516 . . . . 73.34 111.938 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.64 137.73 20.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.081 -0.509 . . . . 64.12 111.673 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -88.6 166.92 13.8 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.108 0.48 . . . . 72.15 111.727 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -87.81 -7.62 57.03 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.359 -0.382 . . . . 64.21 110.95 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.18 135.74 46.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.912 0.387 . . . . 74.23 110.318 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.631 HG12 ' HG2' ' A' ' 29' ' ' ARG . 39.1 mt -111.48 157.75 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.158 0.504 . . . . 73.13 111.564 -173.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' HG23 ' A' ' 41' ' ' ILE . 98.5 mttt -97.32 -55.1 2.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.073 0.463 . . . . 72.32 110.387 171.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -143.9 155.35 44.05 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.989 -0.55 . . . . 74.43 111.348 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.419 ' O ' HG12 ' A' ' 61' ' ' ILE . 39.7 ttm180 -115.99 110.65 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.985 0.421 . . . . 74.21 110.241 175.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 90.9 m -94.98 125.55 39.72 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.292 0.479 . . . . 73.34 112.292 -175.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -108.06 158.08 17.71 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.26 0.553 . . . . 74.12 112.371 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -96.55 107.21 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.539 -0.755 . . . . 75.42 110.659 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.75 HD11 HG21 ' A' ' 59' ' ' VAL . 56.6 mt -120.43 160.56 22.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.204 0.526 . . . . 65.21 111.433 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HZ2' ' HB3' ' A' ' 56' ' ' MET . 29.8 mmmt -115.45 145.6 42.43 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.235 -0.438 . . . . 75.13 110.871 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.1 m . . . . . 0 N--CA 1.475 0.796 0 O-C-N 122.216 -0.303 . . . . 74.12 111.759 179.98 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 121.071 0.462 . . . . 74.1 111.407 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.511 ' HB3' ' HZ2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -89.87 149.19 22.75 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.115 0.483 . . . . 75.33 111.134 176.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.562 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 31.2 pt -124.46 136.3 61.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 73.31 110.668 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.722 ' HA ' HE21 ' A' ' 58' ' ' GLN . 0.0 OUTLIER -94.58 104.41 16.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.428 -0.509 . . . . 65.31 110.461 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.75 HG21 HD11 ' A' ' 48' ' ' LEU . 95.6 t -95.01 117.05 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.937 0.347 . . . . 74.24 111.937 -174.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.7 m -106.97 116.55 32.11 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.381 -0.372 . . . . 62.42 111.191 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.452 HG22 HG13 ' A' ' 105' ' ' ILE . 21.8 pt -110.16 148.9 39.29 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.186 -0.461 . . . . 73.33 111.126 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.34 153.85 56.98 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.517 2.145 . . . . 72.32 113.195 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.42 -19.19 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.55 0.574 . . . . 62.2 112.55 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.8 m -68.35 -9.33 47.3 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.686 0.279 . . . . 70.54 111.689 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.451 HG13 HD13 ' A' ' 61' ' ' ILE . 45.5 t -92.8 132.14 31.96 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 116.481 -0.327 . . . . 65.21 111.501 179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -177.09 1.9 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.594 2.196 . . . . 73.42 113.778 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.462 ' HG ' ' HG2' ' A' ' 69' ' ' GLU . 30.9 tp -82.67 141.68 32.27 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.088 -0.506 . . . . 75.11 111.806 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -102.4 -68.2 0.84 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.858 0.361 . . . . 75.24 111.643 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.462 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 38.1 mm-40 50.75 56.12 8.48 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.668 0.618 . . . . 75.42 112.668 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -75.73 171.49 14.27 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.0 0.429 . . . . 74.44 111.189 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -71.52 151.46 43.87 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 75.1 112.305 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 82.0 t80 -56.98 121.85 10.91 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.726 -0.67 . . . . 65.02 110.798 174.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.691 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.9 OUTLIER 72.09 30.39 2.16 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.678 0.622 . . . . 74.12 112.678 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -84.25 145.1 28.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.535 -0.302 . . . . 62.11 110.512 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -74.46 114.99 13.48 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.165 -0.335 . . . . 72.13 111.458 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.49 HG13 HD22 ' A' ' 107' ' ' LEU . 31.0 m -125.5 147.24 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 120.671 0.272 . . . . 72.45 111.599 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.38 149.59 50.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.876 0.369 . . . . 75.45 110.789 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.407 ' CD2' HG12 ' A' ' 105' ' ' ILE . 98.1 mt -102.16 137.18 40.76 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.591 0.589 . . . . 73.22 112.591 -172.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.8 mm -83.68 106.67 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.909 -0.587 . . . . 71.35 110.515 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.431 ' N ' HD21 ' A' ' 80' ' ' ASN . 0.9 OUTLIER 62.09 64.35 1.86 Allowed Pre-proline 0 N--CA 1.476 0.862 0 CA-C-N 116.268 -0.424 . . . . 72.4 112.138 -178.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.98 128.86 6.7 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.62 2.214 . . . . 65.31 112.979 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.6 pt -135.06 127.48 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.962 0.41 . . . . 75.31 111.565 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.12 99.69 3.44 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.875 -0.417 . . . . 75.02 109.875 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 CA--C 1.541 0.618 0 CA-C-O 121.298 0.57 . . . . 73.11 112.24 -171.259 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.562 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.245 0.823 0 N-CA-C 113.998 1.11 . . . . 74.22 113.998 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.404 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 70.6 m-85 -97.2 117.37 31.26 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.552 -1.204 . . . . 72.1 111.026 175.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 28.6 mt -95.92 105.47 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 121.18 0.514 . . . . 74.12 110.194 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -78.66 136.16 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.171 -0.468 . . . . 73.23 111.306 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.38 155.53 47.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.387 -0.37 . . . . 74.44 110.657 179.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -80.82 -23.64 39.06 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.55 0.214 . . . . 75.5 111.333 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -169.89 159.54 7.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.276 0.56 . . . . 63.0 111.741 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.452 HG13 HG22 ' A' ' 61' ' ' ILE . 37.0 mt -119.57 109.07 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.844 -0.616 . . . . 74.22 111.223 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.0 m -113.16 178.63 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 120.834 0.35 . . . . 72.35 111.084 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.49 HD22 HG13 ' A' ' 76' ' ' VAL . 96.1 mt -88.04 151.33 22.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.19 0.519 . . . . 75.21 111.331 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 110.138 -0.319 . . . . 73.53 110.138 176.417 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.454 ' HB2' HG23 ' A' ' 76' ' ' VAL . 99.1 mt . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 121.141 0.496 . . . . 62.02 110.57 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HZ3' ' HB3' ' A' ' 20' ' ' LYS . 8.1 mtpm? -101.85 105.64 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.189 0.519 . . . . 74.2 111.298 -175.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -58.6 135.49 57.37 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.409 -0.814 . . . . 73.35 112.651 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.6 m -113.17 -62.47 1.58 Allowed 'General case' 0 N--CA 1.471 0.615 0 O-C-N 122.039 -0.413 . . . . 74.3 111.529 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.9 163.17 40.49 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.299 0.571 . . . . 74.14 112.104 -178.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 51.4 tp -74.81 111.8 10.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.319 -0.622 . . . . 74.54 109.319 171.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.49 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 13.4 tpt180 -63.54 -50.03 71.13 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.666 -0.243 . . . . 73.31 111.651 -172.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -176.74 147.58 0.63 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.531 0.567 . . . . 75.34 112.531 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 43.6 mt-10 -105.93 102.38 11.82 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.972 -0.558 . . . . 74.52 110.419 171.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -81.54 113.12 20.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 121.495 0.664 . . . . 73.33 110.267 174.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -101.1 157.1 17.02 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.138 -0.483 . . . . 72.13 110.681 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.2 mt -67.42 108.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.238 0.542 . . . . 71.42 111.741 -175.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -88.94 119.48 29.5 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.364 -0.38 . . . . 71.41 110.925 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.67 158.32 32.49 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.199 0.444 . . . . 74.2 112.199 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.37 -17.31 28.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.374 -0.375 . . . . 72.24 111.558 174.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.34 -4.79 35.53 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.327 -0.397 . . . . 64.11 111.851 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -28.66 10.3 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.318 -0.467 . . . . 42.54 113.181 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.2 m -81.98 153.64 26.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.057 0.456 . . . . 71.11 111.901 -178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.17 133.79 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.133 0.492 . . . . 75.44 111.404 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -84.03 167.33 16.96 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.334 0.588 . . . . 74.04 112.225 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.65 -25.07 64.63 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.758 -0.655 . . . . 72.11 110.72 176.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -76.4 131.33 39.05 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.848 -0.614 . . . . 73.24 111.623 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -94.72 149.0 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.417 -0.356 . . . . 71.43 110.765 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -92.92 -57.36 2.67 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.65 0.262 . . . . 75.31 111.23 -177.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.445 ' OE1' ' HE3' ' A' ' 101' ' ' LYS . 14.7 pt-20 -163.82 168.66 19.3 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.748 0.309 . . . . 72.4 111.22 176.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.51 ' HD3' HD11 ' A' ' 67' ' ' LEU . 45.6 mtt180 -128.18 125.63 39.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.565 0.579 . . . . 75.44 112.565 -174.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 28.9 m -100.05 133.29 44.66 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 116.035 -0.529 . . . . 71.22 112.091 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.59 151.6 35.88 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.076 0.55 . . . . 72.22 112.39 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.49 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 31.8 m-20 -91.24 107.62 19.33 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.048 -0.524 . . . . 71.43 111.276 171.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 59' ' ' VAL . 77.0 mt -116.08 120.72 39.98 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.919 0.39 . . . . 73.4 110.724 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.726 ' NZ ' ' SD ' ' A' ' 56' ' ' MET . 71.7 mmtt -92.7 148.34 22.13 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.41 -0.359 . . . . 74.24 110.853 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.718 0.294 . . . . 55.15 111.568 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 120.596 0.236 . . . . 75.21 110.72 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.726 ' SD ' ' NZ ' ' A' ' 49' ' ' LYS . 21.4 ptt? -145.7 168.8 19.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.926 0.393 . . . . 65.12 111.664 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.56 134.52 46.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.009 -0.541 . . . . 73.15 110.749 176.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.37 105.37 17.45 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.905 0.383 . . . . 73.22 110.506 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 67.5 t -97.33 120.17 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 120.944 0.402 . . . . 74.35 111.927 -173.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 15.4 t -109.47 115.1 29.3 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.911 0.386 . . . . 61.02 111.61 -178.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -103.6 151.57 38.74 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 116.512 -0.313 . . . . 64.13 111.676 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.47 148.6 90.25 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.71 2.273 . . . . 73.11 113.303 -178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -15.07 63.45 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.725 0.639 . . . . 63.41 112.725 -177.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 43.9 t -64.02 -20.58 66.01 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.981 0.42 . . . . 73.2 111.114 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.0 t -92.84 122.69 63.37 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.188 -0.46 . . . . 74.42 111.207 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.09 151.45 16.59 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.97 2.447 . . . . 71.54 113.637 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.51 HD11 ' HD3' ' A' ' 44' ' ' ARG . 28.7 tp -69.73 141.35 53.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.277 -0.419 . . . . 71.25 111.576 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -81.4 -57.63 3.4 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.028 0.751 . . . . 73.31 113.028 -170.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 59.5 41.86 18.51 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.263 0.468 . . . . 71.34 112.263 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.54 168.22 7.74 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.209 0.528 . . . . 75.14 111.651 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.89 153.35 43.39 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.495 -0.32 . . . . 74.42 110.911 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.431 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 59.0 t80 -62.64 119.05 8.49 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.795 0.331 . . . . 72.34 111.335 -178.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 0.9 OUTLIER 71.54 19.8 5.0 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.246 0.618 . . . . 72.22 112.1 -178.159 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.77 141.21 58.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.088 0.47 . . . . 71.15 110.891 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -72.94 112.65 9.17 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.932 -0.577 . . . . 74.43 111.128 -177.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.511 HG11 HD23 ' A' ' 107' ' ' LEU . 32.4 m -126.45 161.47 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.201 0.524 . . . . 71.34 111.891 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 108' ' ' THR . 11.9 pt-20 -143.02 154.26 43.81 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.014 0.435 . . . . 71.11 110.843 176.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.7 mt -95.3 142.66 27.44 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.527 0.565 . . . . 74.51 112.527 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.61 -77.58 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 CA-C-N 116.067 -0.515 . . . . 73.42 110.906 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -130.78 92.23 34.87 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.744 0.306 . . . . 72.41 111.173 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -82.68 156.94 16.11 Favored 'Trans proline' 0 CA--C 1.546 1.095 0 C-N-CA 123.246 2.631 . . . . 72.4 114.25 177.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 pt -145.46 132.87 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.332 0.653 . . . . 74.52 110.558 173.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.04 116.0 15.29 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.12 -0.363 . . . . 53.44 110.857 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.7 t70 . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 120.902 0.382 . . . . 73.52 111.733 -174.081 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 121.274 0.559 . . . . 73.14 112.33 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -111.05 126.09 54.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 121.634 0.73 . . . . 74.42 112.737 -172.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 63.6 mt -116.51 125.1 73.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.557 -0.747 . . . . 75.41 110.937 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.445 ' HE3' ' OE1' ' A' ' 43' ' ' GLU . 56.6 mtpt -90.39 143.14 27.04 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.723 -0.473 . . . . 75.44 109.723 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.95 164.0 29.38 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.054 0.761 . . . . 70.03 113.054 -174.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.3 -58.75 5.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.235 -0.893 . . . . 75.33 110.914 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -164.37 163.25 22.45 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.205 -0.452 . . . . 75.21 111.492 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 50.2 mt -120.02 124.76 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.083 -0.508 . . . . 74.2 111.189 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.2 m -123.34 179.29 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 122.282 -0.261 . . . . 74.33 111.291 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.511 HD23 HG11 ' A' ' 76' ' ' VAL . 93.0 mt -81.04 151.76 28.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.856 0.36 . . . . 75.14 111.311 178.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.408 ' HA ' ' OE1' ' A' ' 77' ' ' GLU . 24.7 m . . . . . 0 N--CA 1.471 0.611 0 CA-C-O 120.898 0.38 . . . . 74.14 111.955 -179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 109.588 -0.523 . . . . 75.44 109.588 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -125.71 129.37 49.4 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.49 0.662 . . . . 73.41 112.665 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -67.66 138.12 56.09 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.313 -0.858 . . . . 74.51 112.348 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.446 ' OG ' ' HD3' ' A' ' 49' ' ' LYS . 59.1 m -113.47 -64.7 1.27 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 111.893 0.331 . . . . 70.22 111.893 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.43 168.97 24.0 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.293 0.568 . . . . 74.41 112.393 -177.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 64.8 tp -81.41 112.09 18.36 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.57 -0.741 . . . . 72.5 110.278 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -68.51 -52.64 29.94 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.81 0.338 . . . . 73.21 111.34 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -175.56 134.84 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.058 0.392 . . . . 75.12 112.058 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.539 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.3 mt-10 -93.16 98.41 11.28 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.895 -0.409 . . . . 73.45 109.895 169.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.5 m -70.41 128.08 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.968 0.414 . . . . 72.04 110.752 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 41' ' ' ILE . 62.6 mtt180 -100.96 168.6 9.51 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.564 0.697 . . . . 75.41 112.804 -175.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.92 112.43 10.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.312 -0.858 . . . . 72.14 111.116 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.5 tt0 -84.96 115.0 22.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.861 0.362 . . . . 74.41 111.081 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -55.76 144.9 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.217 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -55.49 -24.01 29.09 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.365 0.505 . . . . 74.21 112.365 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.76 -37.9 74.45 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.007 0.432 . . . . 74.4 111.552 173.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.52 -17.24 5.57 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.35 -0.453 . . . . 53.31 113.098 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.4 m -94.77 148.83 21.88 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.31 -0.523 . . . . 74.33 111.754 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 34.1 t -82.38 143.62 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 120.949 0.404 . . . . 74.32 111.794 -177.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -94.02 178.84 5.52 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.037 0.446 . . . . 52.14 111.771 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -85.07 -21.42 29.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.3 -0.409 . . . . 74.24 111.29 177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -69.74 136.63 51.18 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.474 -0.33 . . . . 74.35 110.805 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.473 ' HA ' ' HG2' ' A' ' 29' ' ' ARG . 50.7 mt -90.39 144.73 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.339 0.59 . . . . 74.23 111.858 -175.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.489 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 28.9 tptp -97.9 -59.18 1.82 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.626 -0.715 . . . . 63.03 110.904 179.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.489 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.9 mt-10 -145.92 170.21 17.05 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.993 0.425 . . . . 75.42 111.089 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.539 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 54.5 mtt180 -128.1 119.05 24.55 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.778 0.431 . . . . 74.54 111.367 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 62.9 m -100.99 131.42 46.88 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.27 0.47 . . . . 72.34 112.27 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.546 ' HH ' HD11 ' A' ' 61' ' ' ILE . 39.6 m-85 -125.08 156.33 38.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.719 0.407 . . . . 74.24 111.38 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -99.97 123.04 43.78 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.693 -0.23 . . . . 71.34 111.413 173.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.412 HD12 HG21 ' A' ' 59' ' ' VAL . 51.6 mt -119.72 130.21 54.89 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.805 0.336 . . . . 75.43 111.498 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HE3' ' SD ' ' A' ' 56' ' ' MET . 14.3 mptt -80.83 115.54 20.37 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.624 0.249 . . . . 75.35 110.834 173.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 120.679 0.276 . . . . 74.33 111.187 177.387 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 120.982 0.42 . . . . 75.24 111.708 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.511 ' SD ' ' HE3' ' A' ' 49' ' ' LYS . 63.8 mtm -93.56 107.73 19.55 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.638 -0.505 . . . . 71.41 109.638 168.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.451 HD11 HD13 ' A' ' 100' ' ' ILE . 24.2 pt -94.71 134.83 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.465 0.174 . . . . 72.34 111.393 -174.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -90.6 104.94 17.46 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 75.4 111.204 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 91.9 t -96.59 128.37 47.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.91 -0.587 . . . . 75.12 111.31 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.587 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 48.9 m -123.08 137.82 54.83 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 65.02 111.891 -176.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.546 HD11 ' HH ' ' A' ' 46' ' ' TYR . 26.4 pt -124.42 147.81 56.43 Favored Pre-proline 0 N--CA 1.472 0.671 0 CA-C-N 116.213 -0.449 . . . . 74.33 110.798 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.36 150.54 86.82 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.298 1.999 . . . . 74.53 112.482 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.13 -32.94 37.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.763 0.653 . . . . 75.3 112.763 -176.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.8 m -53.46 -32.81 51.69 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.233 0.457 . . . . 71.42 112.233 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -82.08 116.15 61.73 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.616 -0.265 . . . . 72.44 110.748 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -49.74 141.43 27.67 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.163 2.575 . . . . 73.41 113.755 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.545 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 31.6 tp -52.63 138.0 29.44 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.302 -0.408 . . . . 72.04 110.844 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.509 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 24.7 mmmt -79.97 -57.55 3.59 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.621 0.6 . . . . 74.24 112.621 -170.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.545 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 39.2 mt-10 57.86 39.57 26.74 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 112.592 0.59 . . . . 64.13 112.592 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -70.66 172.69 8.23 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.168 0.508 . . . . 74.31 112.056 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.531 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 5.8 m-20 -70.17 157.72 37.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.381 0.61 . . . . 65.22 112.084 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.435 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 7.6 t80 -70.66 117.38 12.11 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.793 -0.639 . . . . 72.35 110.902 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 46.9 m-80 74.92 21.82 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.592 0.757 . . . . 64.44 112.069 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.531 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -74.95 141.63 44.04 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.963 0.357 . . . . 63.14 111.963 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.473 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 70.7 mtm180 -67.45 116.16 7.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.599 -0.273 . . . . 71.01 110.717 178.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.52 140.03 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-O 121.042 0.449 . . . . 75.41 112.171 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -124.53 157.16 35.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.232 0.539 . . . . 70.11 111.025 178.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.95 132.13 45.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.262 -0.427 . . . . 72.0 111.777 -176.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.576 HG21 ' ND2' ' A' ' 80' ' ' ASN . 50.0 mm -63.62 -72.61 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 116.28 -0.418 . . . . 75.11 111.364 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.576 ' ND2' HG21 ' A' ' 79' ' ' ILE . 41.0 m-80 -125.32 89.96 51.64 Favored Pre-proline 0 N--CA 1.476 0.858 0 CA-C-O 120.573 0.225 . . . . 74.13 110.452 174.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.87 147.7 15.24 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.202 2.601 . . . . 64.45 114.352 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 101' ' ' LYS . 38.4 pt -140.04 149.14 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.967 0.413 . . . . 73.15 110.78 172.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.14 116.51 28.87 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.916 0.388 . . . . 70.25 110.816 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.525 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . 17.9 t70 . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 121.479 0.657 . . . . 74.12 112.442 -174.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.965 0 CA-C-O 122.545 1.164 . . . . 73.45 113.982 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -110.39 122.27 47.28 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.25 -1.341 . . . . 75.34 111.094 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 34.6 mt -105.27 104.63 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.085 0.469 . . . . 73.44 110.46 177.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.587 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 50.3 mtpt -87.42 130.26 34.73 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.997 -0.44 . . . . 75.22 111.17 -176.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.12 157.93 31.81 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.651 0.611 . . . . 50.55 112.651 -173.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 28.9 t70 -66.95 -38.37 86.01 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.469 -0.787 . . . . 75.43 111.294 175.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -169.8 161.08 8.98 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.168 -0.469 . . . . 72.54 110.951 176.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.509 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 42.3 mt -119.28 120.98 65.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.148 -0.478 . . . . 65.4 110.883 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.8 m -120.42 -179.65 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 122.218 -0.301 . . . . 74.05 111.105 178.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.5 128.47 35.23 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.944 0.402 . . . . 74.41 111.901 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 26.4 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.429 0.633 . . . . 74.43 111.234 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 50' ' ' SER . 97.2 mt . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.804 0.335 . . . . 74.24 111.222 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -102.62 139.06 38.7 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.987 0.423 . . . . 74.32 111.21 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.592 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 67.5 t80 -71.98 102.06 2.85 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.275 -0.421 . . . . 73.21 110.581 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.532 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.3 t -73.29 -64.83 0.9 Allowed 'General case' 0 N--CA 1.472 0.625 0 O-C-N 122.018 -0.426 . . . . 71.01 111.864 -175.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.57 171.67 17.65 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.608 0.596 . . . . 75.43 112.608 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.439 HD12 ' CE2' ' A' ' 46' ' ' TYR . 37.1 tp -90.06 105.83 18.07 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.853 -0.612 . . . . 74.13 109.486 169.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -65.82 -53.14 43.96 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.487 -0.324 . . . . 75.41 111.546 -175.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -177.01 141.21 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.247 0.462 . . . . 75.05 112.247 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.41 98.89 11.51 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.647 -0.501 . . . . 71.02 109.647 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.408 HG21 ' HB3' ' A' ' 42' ' ' LYS . 31.9 m -78.16 144.78 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-O 121.303 0.573 . . . . 74.5 111.773 -174.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm180 -109.56 168.35 9.46 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.949 -0.569 . . . . 71.32 112.109 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.0 mt -80.99 141.78 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.977 -0.556 . . . . 74.0 111.164 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -95.45 150.74 19.96 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.088 0.471 . . . . 74.33 111.707 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -93.55 155.45 17.3 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.489 -0.323 . . . . 74.42 110.427 174.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -62.19 -21.34 65.02 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.216 0.532 . . . . 74.43 111.344 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.54 -31.89 70.97 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.917 -0.583 . . . . 62.25 111.582 172.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.53 -34.86 4.47 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 116.222 -0.444 . . . . 51.34 112.156 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.7 m -68.14 153.92 42.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.004 0.431 . . . . 74.2 111.319 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -87.28 146.33 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 120.819 0.343 . . . . 73.43 111.5 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.9 t -90.53 172.4 8.73 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.213 0.53 . . . . 74.35 112.208 -179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -81.07 -15.54 55.72 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.998 -0.546 . . . . 63.32 110.628 173.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.08 135.87 56.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.817 -0.629 . . . . 74.3 110.75 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.93 142.96 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-O 120.929 0.395 . . . . 73.34 111.266 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB3' HG21 ' A' ' 28' ' ' VAL . 29.1 tptp -98.31 -58.26 2.01 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.955 0.407 . . . . 64.13 111.267 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -164.4 166.44 20.65 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.089 0.471 . . . . 71.43 111.291 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 60' ' ' SER . 38.3 mtt180 -114.5 114.39 25.73 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.001 0.371 . . . . 75.33 112.001 -173.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.0 m -91.64 126.92 36.89 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.169 -0.469 . . . . 72.41 112.055 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.737 ' HH ' HD11 ' A' ' 67' ' ' LEU . 92.8 m-85 -123.61 151.75 42.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.209 0.604 . . . . 73.21 111.527 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -102.08 119.27 38.53 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.938 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.587 HD12 HG21 ' A' ' 59' ' ' VAL . 39.6 mt -114.55 141.22 48.02 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.987 0.422 . . . . 75.51 111.922 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.532 ' HG2' ' HB2' ' A' ' 22' ' ' SER . 29.0 mmmt -96.21 124.54 40.25 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.0 -0.545 . . . . 73.41 111.121 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.403 ' HA ' HD23 ' A' ' 19' ' ' LEU . 29.1 t . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 120.894 0.378 . . . . 74.54 111.477 177.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 . . . . . 0 CA--C 1.537 0.473 0 CA-C-O 121.27 0.557 . . . . 72.14 111.448 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.0 OUTLIER -110.16 131.25 55.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.897 -0.592 . . . . 70.23 110.904 175.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.501 HD11 HD11 ' A' ' 100' ' ' ILE . 24.4 pt -115.02 142.99 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 116.523 -0.308 . . . . 71.24 111.359 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.2 mp0 -89.99 104.99 17.5 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.82 0.343 . . . . 74.24 110.572 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.587 HG21 HD12 ' A' ' 48' ' ' LEU . 87.2 t -100.6 129.94 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.079 -0.388 . . . . 70.54 111.424 -178.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.488 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 38.2 t -127.7 151.14 49.34 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.336 0.589 . . . . 75.53 112.275 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.9 pt -134.42 141.04 37.56 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 115.861 -0.609 . . . . 72.4 110.609 176.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.41 ' HG2' HG23 ' A' ' 65' ' ' VAL . 15.5 Cg_endo -56.35 152.25 40.25 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.4 2.067 . . . . 74.24 112.936 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.59 -30.12 19.82 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.301 0.852 . . . . 73.3 113.301 -177.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.5 p -67.26 -20.26 65.63 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.412 0.523 . . . . 70.32 112.412 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.41 HG23 ' HG2' ' A' ' 62' ' ' PRO . 53.2 t -84.78 132.27 46.79 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 120.536 0.208 . . . . 64.13 111.37 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.04 158.98 8.14 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.114 2.543 . . . . 74.14 113.818 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.737 HD11 ' HH ' ' A' ' 46' ' ' TYR . 58.5 tp -76.0 129.65 37.2 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.954 -0.566 . . . . 63.21 111.77 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.41 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 0.0 OUTLIER -86.88 123.46 32.04 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.113 0.482 . . . . 75.12 111.366 174.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -116.72 49.28 1.18 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.715 -0.675 . . . . 71.44 111.397 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -84.4 177.01 8.31 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.948 0.722 . . . . 74.35 112.948 -174.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.3 159.25 15.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.553 -0.749 . . . . 71.31 111.624 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.592 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.1 t80 -59.86 -35.35 74.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.298 0.481 . . . . 74.22 112.298 -179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.433 ' ND2' ' HD2' ' A' ' 72' ' ' TYR . 5.5 m120 -93.73 2.65 56.21 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 122.133 -0.355 . . . . 74.02 111.474 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.17 135.04 42.81 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.015 0.436 . . . . 62.23 111.802 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -79.53 126.42 30.85 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.166 -0.47 . . . . 74.0 110.327 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.2 m -129.28 142.45 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.284 0.564 . . . . 72.0 112.516 -178.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.458 ' HB3' ' HG1' ' A' ' 108' ' ' THR . 12.1 pt-20 -131.25 170.53 14.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.928 -0.578 . . . . 64.13 110.773 177.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.422 HD23 HG11 ' A' ' 59' ' ' VAL . 87.4 mt -114.3 133.36 55.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.866 0.365 . . . . 75.31 111.923 -176.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.576 HG23 ' ND2' ' A' ' 80' ' ' ASN . 50.1 mm -64.97 -65.58 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.158 -0.474 . . . . 63.23 111.645 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.576 ' ND2' HG23 ' A' ' 79' ' ' ILE . 56.2 m-80 -129.04 89.24 49.18 Favored Pre-proline 0 N--CA 1.474 0.744 0 O-C-N 122.18 -0.325 . . . . 63.51 110.669 174.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.04 141.7 13.26 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.927 2.418 . . . . 72.32 114.07 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.483 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.5 pt -133.34 129.66 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.982 0.42 . . . . 75.44 110.787 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.86 114.26 8.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.865 0.364 . . . . 62.44 110.825 175.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 CA--C 1.539 0.531 0 CA-C-O 121.447 0.641 . . . . 71.42 111.878 -176.302 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 N-CA-C 114.618 1.34 . . . . 71.21 114.618 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 51.6 m-85 -110.95 136.66 49.63 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.766 -1.561 . . . . 75.14 111.34 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.501 HD11 HD11 ' A' ' 57' ' ' ILE . 51.1 mt -114.72 105.5 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.182 0.515 . . . . 74.41 109.62 171.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.488 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 38.0 mtmt -96.19 133.1 40.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.996 0.427 . . . . 74.4 111.09 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.38 158.44 26.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.464 0.649 . . . . 72.14 112.702 -172.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.473 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 19.9 t70 -59.58 -37.48 78.61 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.263 -0.881 . . . . 71.31 110.976 171.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -170.7 152.86 3.88 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.787 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.41 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 68.0 mt -108.93 118.82 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.767 -0.652 . . . . 74.34 110.953 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -127.16 164.69 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 121.038 0.447 . . . . 71.35 112.071 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 90.6 mt -76.81 137.64 39.35 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.39 0.614 . . . . 73.01 112.236 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.458 ' HG1' ' HB3' ' A' ' 77' ' ' GLU . 5.1 m . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 115.924 -0.58 . . . . 75.01 110.375 174.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.4 mt . . . . . 0 N--CA 1.464 0.252 0 N-CA-C 110.055 -0.35 . . . . 75.4 110.055 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -102.79 123.31 46.23 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.302 0.573 . . . . 73.51 112.198 -176.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -67.49 143.57 56.12 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.253 -0.885 . . . . 61.5 111.456 -179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -123.53 -62.94 1.27 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.792 0.294 . . . . 72.52 111.792 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.61 164.14 36.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.248 0.547 . . . . 65.34 112.327 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.61 115.04 9.32 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.888 -0.596 . . . . 75.51 110.707 173.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.41 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 8.4 tpt180 -73.04 -59.72 2.57 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.948 0.404 . . . . 74.4 111.493 -176.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -161.92 139.68 8.82 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.043 0.386 . . . . 70.2 112.043 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -99.8 99.96 10.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.396 -0.594 . . . . 73.24 109.396 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.495 HG21 ' HB2' ' A' ' 42' ' ' LYS . 16.0 m -68.19 87.98 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.784 0.802 . . . . 74.01 111.254 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.74 ' HG2' HG12 ' A' ' 41' ' ' ILE . 46.8 mtt180 -82.07 155.91 24.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.884 -0.598 . . . . 74.14 111.825 -176.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.653 HG12 ' HE2' ' A' ' 42' ' ' LYS . 54.2 mt -68.63 107.47 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 115.862 -0.608 . . . . 70.41 111.829 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.45 112.61 20.53 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.034 0.445 . . . . 74.42 110.227 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -60.04 164.72 3.79 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.798 -0.637 . . . . 61.54 112.51 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.2 -32.07 64.05 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.304 0.573 . . . . 72.42 110.911 176.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.24 -8.22 43.89 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.633 -0.712 . . . . 74.32 111.865 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.04 -3.49 82.62 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.231 -0.509 . . . . 73.12 113.027 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.4 p -84.15 155.21 22.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.859 0.361 . . . . 71.21 111.479 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 43.9 t -95.74 124.31 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.885 0.374 . . . . 75.32 111.563 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 t -85.7 152.72 22.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.353 -0.385 . . . . 73.44 111.446 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.85 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.937 0.398 . . . . 64.14 111.029 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.85 143.05 58.2 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.244 0.545 . . . . 71.32 111.806 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.74 HG12 ' HG2' ' A' ' 29' ' ' ARG . 31.1 mt -113.06 145.93 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.672 -175.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.653 ' HE2' HG12 ' A' ' 30' ' ' ILE . 73.9 mmtt -78.76 -50.66 10.99 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.233 0.539 . . . . 71.33 110.176 170.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.84 168.18 8.93 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.732 -0.667 . . . . 74.34 111.404 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.3 mtt180 -114.87 117.19 29.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.694 0.398 . . . . 74.34 112.032 -173.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.1 m -96.32 132.42 41.82 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.338 -0.392 . . . . 74.32 111.788 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.528 ' HH ' HD11 ' A' ' 67' ' ' LEU . 66.9 m-85 -122.97 153.97 39.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.679 0.391 . . . . 70.42 111.659 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.41 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 61.4 m-20 -88.48 113.17 23.78 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.693 0.282 . . . . 64.3 111.664 175.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.588 HD12 HG21 ' A' ' 59' ' ' VAL . 67.5 mt -113.19 122.14 46.6 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.011 0.434 . . . . 75.23 110.865 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -94.5 141.12 28.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.094 0.474 . . . . 74.32 112.076 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB2' ' HG2' ' A' ' 55' ' ' ARG . 19.6 m . . . . . 0 N--CA 1.472 0.637 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.514 175.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.429 ' HG2' ' HB2' ' A' ' 50' ' ' SER . 15.8 ptt180 . . . . . 0 N--CA 1.471 0.612 0 CA-C-O 121.213 0.53 . . . . 74.51 111.86 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.474 ' SD ' ' N ' ' A' ' 56' ' ' MET . 3.3 mpp? -111.8 108.4 17.79 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.824 -0.625 . . . . 74.11 110.055 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.5 pt -98.1 144.71 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.715 0.293 . . . . 72.0 111.091 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 87.4 mm-40 -97.48 105.05 17.13 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.055 0.455 . . . . 75.42 110.973 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.588 HG21 HD12 ' A' ' 48' ' ' LEU . 98.9 t -107.19 128.31 62.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 116.442 -0.345 . . . . 74.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 31.5 t -126.46 134.72 50.88 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.295 0.48 . . . . 63.33 112.295 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.6 pt -115.13 143.98 31.27 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 116.271 -0.422 . . . . 74.11 111.192 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.65 147.38 60.1 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.585 2.19 . . . . 74.1 113.193 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.03 -16.89 20.75 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.057 0.762 . . . . 75.13 113.057 -176.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 m -74.96 -4.53 38.73 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.025 0.38 . . . . 41.41 112.025 177.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.417 HG11 ' HZ3' ' A' ' 68' ' ' LYS . 48.8 t -102.19 131.43 22.62 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 122.487 0.315 . . . . 74.4 111.201 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.99 146.03 17.91 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.003 2.468 . . . . 75.51 113.869 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.528 HD11 ' HH ' ' A' ' 46' ' ' TYR . 60.0 tp -70.01 136.83 50.81 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.939 -0.573 . . . . 74.42 111.686 -178.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HZ3' HG11 ' A' ' 65' ' ' VAL . 9.5 mptt -87.68 133.2 33.88 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.168 0.508 . . . . 75.42 112.12 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -117.9 30.92 6.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.644 -0.707 . . . . 64.3 111.161 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -64.54 161.39 17.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.637 0.606 . . . . 75.24 112.637 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -83.49 163.58 20.38 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.636 -0.711 . . . . 54.02 112.102 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -64.17 120.92 13.02 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.25 -0.432 . . . . 74.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 66.4 34.3 6.38 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 70.41 111.865 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.58 118.68 20.22 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.471 -0.331 . . . . 71.43 111.198 175.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -60.11 108.87 0.84 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.877 0.37 . . . . 63.43 111.663 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.462 HG13 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.85 169.75 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.407 0.622 . . . . 74.05 111.817 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.87 157.96 44.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.043 -0.526 . . . . 72.23 110.697 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 93.5 mt -102.65 126.55 49.79 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.944 0.35 . . . . 73.53 111.944 -175.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.612 HG23 ' ND2' ' A' ' 80' ' ' ASN . 50.2 mm -56.13 -59.99 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 116.266 -0.424 . . . . 73.33 111.622 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.612 ' ND2' HG23 ' A' ' 79' ' ' ILE . 61.0 m-80 -137.03 91.56 14.82 Favored Pre-proline 0 N--CA 1.473 0.702 0 O-C-N 122.237 -0.289 . . . . 73.01 111.257 174.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.75 141.47 12.18 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.019 2.479 . . . . 74.21 113.615 176.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -141.78 131.26 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-O 121.042 0.449 . . . . 73.32 111.231 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.34 110.11 9.42 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.227 -0.296 . . . . 74.42 110.457 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.6 t70 . . . . . 0 CA--C 1.549 0.914 0 C-N-CA 121.2 -0.2 . . . . 74.32 111.264 -171.916 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 . . . . . 0 C--O 1.243 0.745 0 CA-C-O 121.384 0.612 . . . . 74.52 111.858 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -112.67 126.65 55.62 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.54 -0.755 . . . . 75.4 112.946 -171.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.413 ' HB ' HG23 ' A' ' 59' ' ' VAL . 57.3 mt -111.07 115.93 51.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.197 -0.91 . . . . 74.51 110.291 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -84.8 134.85 34.3 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.078 -0.389 . . . . 75.34 110.898 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.1 143.96 50.92 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.227 0.537 . . . . 61.3 112.165 -176.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.0 t70 -65.01 -40.03 94.31 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.884 -0.598 . . . . 72.21 111.422 176.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.429 ' HB3' HG13 ' A' ' 79' ' ' ILE . 22.1 t0 -170.42 161.61 8.03 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 116.383 -0.371 . . . . 75.53 110.817 178.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 36.5 mt -122.66 122.13 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 116.527 -0.306 . . . . 74.12 111.302 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.7 m -126.35 176.57 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.64 0.257 . . . . 72.33 111.026 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.462 HD23 HG13 ' A' ' 76' ' ' VAL . 97.2 mt -76.05 145.41 40.17 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.176 -0.327 . . . . 73.31 111.417 177.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.595 0.236 . . . . 75.33 110.873 177.764 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.6 mt . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.094 -0.336 . . . . 75.0 110.094 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HD2' ' O ' ' A' ' 73' ' ' ASN . 46.9 mtmt -132.83 138.81 47.2 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 122.036 -0.415 . . . . 73.52 112.027 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -70.2 140.03 52.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.057 0.391 . . . . 70.33 112.057 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 94.8 p -125.97 -62.39 1.18 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.011 0.374 . . . . 75.13 112.011 177.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -149.98 -173.6 4.48 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.494 0.553 . . . . 73.32 112.494 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 tp -104.85 123.79 48.32 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.237 -0.438 . . . . 75.25 110.754 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -73.16 -64.75 0.91 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.095 0.406 . . . . 74.44 112.095 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -170.16 143.45 2.44 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.071 0.462 . . . . 74.45 111.905 -174.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.425 ' HG2' ' HG3' ' A' ' 44' ' ' ARG . 43.3 mt-10 -106.13 108.96 20.75 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.18 -0.464 . . . . 74.53 110.481 173.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -85.95 110.05 19.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 121.304 0.573 . . . . 70.42 111.17 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.658 ' HG2' HG12 ' A' ' 41' ' ' ILE . 73.7 mtm180 -99.9 178.48 4.8 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.474 0.654 . . . . 73.24 112.761 -174.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.615 HG12 ' HZ1' ' A' ' 42' ' ' LYS . 65.1 mt -84.06 124.17 39.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.496 -0.774 . . . . 74.31 110.639 177.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -98.35 133.78 42.28 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.999 0.428 . . . . 74.43 111.698 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -68.94 143.72 54.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.249 -0.432 . . . . 72.41 110.741 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.59 -17.68 48.02 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.139 0.495 . . . . 75.11 111.636 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.12 -39.75 71.86 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.069 0.461 . . . . 75.03 111.253 174.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.5 -46.22 0.82 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.372 -0.442 . . . . 73.44 112.916 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.2 p -61.46 160.79 10.42 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 120.991 0.424 . . . . 55.41 111.931 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.4 t -107.97 136.89 41.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-O 121.024 0.44 . . . . 75.11 111.793 -177.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 t -79.83 168.88 18.7 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.272 0.558 . . . . 73.44 111.895 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.42 -26.74 55.82 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.206 -0.452 . . . . 74.1 111.813 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 142.69 57.94 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.268 0.556 . . . . 65.4 111.453 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.658 HG12 ' HG2' ' A' ' 29' ' ' ARG . 24.1 mt -115.48 145.04 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 116.066 -0.516 . . . . 65.42 111.934 -172.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.615 ' HZ1' HG12 ' A' ' 30' ' ' ILE . 38.7 mmtm -78.58 -57.79 3.59 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.146 0.498 . . . . 73.12 110.389 173.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.44 167.75 25.02 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.157 0.503 . . . . 64.4 111.478 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.425 ' HG3' ' HG2' ' A' ' 27' ' ' GLU . 44.8 ttm180 -125.51 123.71 39.76 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.927 0.394 . . . . 72.35 111.752 -172.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 16.9 m -102.3 128.84 48.68 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 116.2 -0.455 . . . . 75.5 112.175 -177.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -109.9 160.26 16.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.71 0.404 . . . . 74.44 111.369 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.05 124.1 42.39 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.476 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.42 ' HB2' HG13 ' A' ' 57' ' ' ILE . 73.3 mt -123.52 130.32 52.51 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.151 0.5 . . . . 74.53 111.535 178.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 49' ' ' LYS . 1.8 mmmp? -80.77 128.57 33.79 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.444 -0.344 . . . . 75.43 110.64 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.235 0.458 . . . . 61.22 112.235 -175.546 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 120.825 0.345 . . . . 72.43 110.935 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -108.55 177.62 4.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.691 0.281 . . . . 72.43 110.492 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.42 HG13 ' HB2' ' A' ' 48' ' ' LEU . 36.4 pt -131.62 138.24 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.962 0.41 . . . . 65.52 111.81 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -104.74 105.68 15.86 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.033 0.444 . . . . 74.11 110.622 175.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 93.5 t -100.07 126.59 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.308 0.484 . . . . 64.42 112.308 -173.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 14.3 t -114.03 123.07 48.78 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.712 0.291 . . . . 65.02 111.749 -176.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 pt -114.03 155.1 45.85 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.543 -0.299 . . . . 74.32 111.368 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.27 138.73 80.23 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 122.778 2.319 . . . . 73.24 113.297 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.74 -13.81 62.43 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.668 0.618 . . . . 73.12 112.668 -176.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.1 m -73.83 0.67 12.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 120.938 0.399 . . . . 71.52 111.169 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 94.5 t -101.77 129.96 25.52 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 122.816 0.446 . . . . 74.23 110.849 176.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.46 156.18 27.5 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.658 2.239 . . . . 74.42 113.438 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 39.7 tp -69.45 145.75 52.53 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.088 -0.506 . . . . 73.42 111.563 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.466 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 13.5 mptt -93.62 -66.13 0.94 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.986 0.736 . . . . 74.41 112.986 -176.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.534 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.1 mt-10 60.88 49.28 6.09 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.861 0.319 . . . . 65.44 111.861 -177.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.51 176.41 1.11 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.479 0.657 . . . . 73.13 112.644 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.497 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 16.7 m-20 -71.77 153.85 41.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.703 -0.68 . . . . 73.33 111.843 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -67.49 119.57 12.52 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.95 -0.568 . . . . 75.1 111.263 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.438 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 40.5 m-80 61.97 34.33 16.8 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.584 0.587 . . . . 74.32 112.584 -177.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -88.03 142.18 27.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.719 -0.219 . . . . 73.02 111.142 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 115.96 4.58 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.383 0.611 . . . . 75.12 112.388 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.5 m -125.31 146.94 30.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.587 -0.733 . . . . 71.51 111.208 177.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -125.65 162.99 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.313 0.577 . . . . 73.22 111.316 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.462 HD11 HG23 ' A' ' 59' ' ' VAL . 86.7 mt -110.17 137.67 47.59 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.226 -0.443 . . . . 75.22 111.731 -176.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.468 ' N ' HD13 ' A' ' 79' ' ' ILE . 1.9 mp -67.11 -68.42 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 116.286 -0.416 . . . . 74.34 110.925 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.472 ' O ' ' HA ' ' A' ' 102' ' ' ALA . 80.9 m-20 -122.72 85.99 49.56 Favored Pre-proline 0 N--CA 1.473 0.693 0 CA-C-N 116.679 -0.237 . . . . 75.02 111.191 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.73 129.81 6.52 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.808 2.339 . . . . 64.43 113.449 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.8 pt -137.86 130.97 41.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 121.162 0.506 . . . . 72.2 111.046 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.66 127.65 32.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.775 0.321 . . . . 72.51 111.425 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 112.152 0.427 . . . . 72.51 112.152 -178.709 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 CA--C 1.543 0.699 0 CA-C-O 121.651 0.739 . . . . 73.53 112.607 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.2 138.93 34.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.483 -0.78 . . . . 73.41 112.061 -178.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.557 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 50.5 mt -124.67 114.64 41.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 115.724 -0.671 . . . . 74.2 110.142 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -83.4 139.12 33.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.068 -0.395 . . . . 74.5 110.387 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 80' ' ' ASN . . . -141.16 160.49 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.29 0.566 . . . . 61.51 112.39 -175.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.427 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 34.7 t70 -63.01 -55.39 26.04 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.606 -0.725 . . . . 64.14 110.986 175.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -163.19 164.85 25.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.11 -0.495 . . . . 74.24 110.896 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.466 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 52.3 mt -115.04 117.34 55.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.087 0.555 . . . . 74.22 111.234 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.34 175.28 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.154 -0.341 . . . . 75.32 111.425 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.12 138.13 39.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.723 0.297 . . . . 74.22 111.45 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.5 m . . . . . 0 N--CA 1.469 0.525 0 CA-C-O 120.902 0.382 . . . . 72.33 111.758 -179.124 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 95.3 mt . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 120.773 0.32 . . . . 71.42 110.58 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.461 ' HB2' ' HD3' ' A' ' 49' ' ' LYS . 57.6 mttp -112.78 130.77 55.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.911 0.386 . . . . 72.21 111.387 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.85 132.39 48.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.92 -0.582 . . . . 64.12 111.207 177.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 m -116.75 -64.31 1.33 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.894 0.378 . . . . 72.52 111.607 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.68 -175.41 5.14 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.06 0.457 . . . . 73.0 111.894 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -105.89 107.24 18.14 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.166 -0.47 . . . . 72.4 110.127 175.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -59.01 -52.88 63.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.547 0.573 . . . . 75.4 112.547 -174.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -174.42 134.93 0.41 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.77 0.656 . . . . 73.22 112.77 -174.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -105.18 106.16 16.53 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.34 -0.391 . . . . 73.04 110.351 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -78.36 113.1 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.066 0.46 . . . . 72.33 111.505 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.624 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 96.0 mtt180 -79.95 161.96 25.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.278 0.561 . . . . 74.55 112.375 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -77.01 105.5 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 115.721 -0.672 . . . . 74.13 111.267 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 64.4 tt0 -77.85 121.18 23.76 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.891 0.377 . . . . 72.44 111.23 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -65.84 147.21 53.74 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.942 0.401 . . . . 74.11 111.574 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -63.33 -13.96 44.66 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.122 -0.49 . . . . 74.53 111.465 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.51 -23.93 61.08 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.049 0.452 . . . . 74.41 111.342 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.75 -42.87 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.442 -0.408 . . . . 72.21 112.97 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.0 m -74.5 159.88 31.66 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.093 0.473 . . . . 73.12 111.903 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 50.1 t -92.59 137.08 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.889 0.376 . . . . 71.33 111.527 -178.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.8 t -79.64 179.67 7.37 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.396 0.617 . . . . 73.34 111.884 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -78.49 -44.95 23.23 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.034 -0.53 . . . . 74.21 110.997 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -72.82 157.6 37.16 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.244 0.831 . . . . 62.52 113.244 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.624 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 34.2 mt -104.06 152.44 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.442 -0.799 . . . . 54.34 111.699 -176.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -91.95 -58.34 2.43 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.045 0.45 . . . . 73.53 111.254 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -153.97 160.66 42.16 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 120.882 0.372 . . . . 65.11 111.217 176.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 44' ' ' ARG . 5.5 ptp85 -125.63 126.44 44.73 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.563 0.579 . . . . 74.2 112.563 -174.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.8 m -96.6 129.12 44.05 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.735 -0.666 . . . . 74.21 111.991 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.433 ' OH ' HD11 ' A' ' 67' ' ' LEU . 66.1 m-85 -107.82 163.53 13.04 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 121.23 0.538 . . . . 71.3 112.138 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -106.94 108.35 19.82 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.58 -0.736 . . . . 73.52 111.472 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.9 mt -122.64 125.92 46.6 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 122.29 -0.256 . . . . 74.41 110.895 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HD3' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -94.11 134.48 36.5 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.87 -0.518 . . . . 73.34 112.022 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.472 0.664 0 CA-C-N 116.149 -0.478 . . . . 74.3 111.442 -178.789 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 . . . . . 0 N--CA 1.469 0.477 0 CA-C-O 121.195 0.521 . . . . 73.12 111.942 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.476 ' SD ' ' N ' ' A' ' 56' ' ' MET . 1.5 pmm? -102.14 147.69 26.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.857 -0.611 . . . . 74.4 111.377 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.8 pt -103.52 137.82 30.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.025 177.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -93.45 104.68 16.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.182 -0.463 . . . . 70.42 110.394 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -105.36 112.43 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.813 0.34 . . . . 64.34 111.728 -175.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 98.2 p -103.91 130.74 51.54 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.269 0.557 . . . . 72.32 111.874 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -125.21 152.36 70.81 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 116.127 -0.488 . . . . 74.21 111.095 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.78 142.54 41.38 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.716 2.277 . . . . 74.23 113.508 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.52 -30.81 69.97 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.925 0.393 . . . . 75.43 111.966 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.9 t -61.08 -22.74 64.9 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.087 0.47 . . . . 74.44 111.306 176.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.83 127.81 84.76 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 116.462 -0.336 . . . . 71.44 110.547 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.38 144.01 92.56 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.917 2.411 . . . . 74.43 113.741 -175.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.433 HD11 ' OH ' ' A' ' 46' ' ' TYR . 24.3 tp -60.45 146.71 43.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.468 -0.787 . . . . 73.52 110.608 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HD2' ' N ' ' A' ' 68' ' ' LYS . 3.6 mptp? -88.09 -56.79 3.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.95 0.722 . . . . 63.24 112.95 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 59.65 21.95 10.65 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.569 0.581 . . . . 73.03 112.569 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.21 164.98 14.64 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.2 0.524 . . . . 74.54 112.172 -177.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -65.1 146.91 54.37 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.432 0.634 . . . . 60.31 112.568 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.09 123.94 19.49 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.434 -0.803 . . . . 73.44 111.627 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.0 m120 71.03 16.71 6.36 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.21 0.604 . . . . 64.43 112.53 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.21 149.06 32.03 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.149 -0.344 . . . . 75.11 111.09 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.56 123.85 22.38 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.911 0.386 . . . . 74.52 111.427 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.47 HG11 HD23 ' A' ' 107' ' ' LEU . 30.4 m -127.21 140.47 49.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 121.052 0.453 . . . . 74.52 111.075 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -123.73 153.33 41.04 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.202 0.525 . . . . 75.23 111.151 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.417 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.7 mt -93.61 146.46 23.8 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.195 -0.457 . . . . 75.11 111.732 -177.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.523 HG23 ' ND2' ' A' ' 80' ' ' ASN . 49.6 mm -77.0 -67.32 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.24 -0.436 . . . . 74.44 111.005 176.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.523 ' ND2' HG23 ' A' ' 79' ' ' ILE . 51.7 m-80 -124.42 88.19 53.4 Favored Pre-proline 0 N--CA 1.473 0.714 0 O-C-N 122.2 -0.312 . . . . 73.34 110.838 174.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.32 128.52 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.946 2.431 . . . . 73.43 113.868 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.6 pt -137.58 123.83 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.166 0.508 . . . . 62.44 111.02 171.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 142.42 48.79 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 122.121 -0.362 . . . . 74.13 110.381 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 t70 . . . . . 0 CA--C 1.537 0.465 0 CA-C-O 121.317 0.58 . . . . 73.41 112.095 -175.982 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 . . . . . 0 N--CA 1.47 0.574 0 CA-C-O 121.101 0.477 . . . . 74.23 111.63 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -111.05 128.65 55.93 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.029 0.751 . . . . 61.22 113.029 -171.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 66.4 mt -120.57 128.36 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.279 -0.873 . . . . 75.24 110.527 177.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.35 131.4 42.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.905 0.383 . . . . 74.3 110.278 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.65 162.92 24.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.513 0.673 . . . . 72.53 112.605 -176.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -78.3 -40.55 36.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.19 -0.914 . . . . 74.04 111.425 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -169.44 155.89 6.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.003 0.43 . . . . 73.35 111.46 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.444 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 31.7 mt -120.92 118.68 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 115.892 -0.595 . . . . 74.45 110.722 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.9 m -122.75 168.93 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 120.934 0.397 . . . . 73.01 111.626 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.47 HD23 HG11 ' A' ' 76' ' ' VAL . 69.2 mt -74.73 133.57 42.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.809 0.338 . . . . 72.15 111.494 176.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.534 0.339 0 CA-C-N 116.475 -0.33 . . . . 73.44 110.381 176.255 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 96.8 mt . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.831 0.348 . . . . 75.5 111.306 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.521 ' N ' ' HE2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -102.62 112.93 25.9 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.483 -0.326 . . . . 75.12 111.075 176.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.45 ' HE1' ' CD1' ' A' ' 46' ' ' TYR . 86.0 t80 -78.82 113.25 16.74 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.254 -0.43 . . . . 73.25 111.742 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.6 p -101.19 -60.09 1.59 Allowed 'General case' 0 N--CA 1.474 0.741 0 O-C-N 122.109 -0.37 . . . . 74.34 111.919 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.16 173.95 15.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.91 0.707 . . . . 42.24 112.91 -178.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -92.65 116.65 29.2 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.525 -0.761 . . . . 73.42 110.984 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 19.3 tpt180 -71.51 -54.61 10.0 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.405 0.52 . . . . 73.5 112.405 -173.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -164.7 146.9 8.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.081 0.467 . . . . 75.25 111.922 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.4 mt-10 -114.03 99.39 7.61 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.018 -0.537 . . . . 64.21 110.501 175.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -71.91 120.57 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.358 0.599 . . . . 70.34 110.702 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.2 mtt180 -98.16 165.94 11.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.349 0.595 . . . . 75.53 112.301 -173.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.9 mt -69.34 112.51 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.659 -0.7 . . . . 72.14 111.319 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -86.51 120.18 27.56 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.14 -0.482 . . . . 72.12 110.838 -178.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.05 173.7 5.25 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.132 0.79 . . . . 75.4 113.132 -174.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -53.98 -41.5 67.97 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.55 -0.75 . . . . 65.11 112.344 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.7 -26.93 68.88 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.068 0.461 . . . . 72.34 112.053 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.14 -15.97 30.34 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.07 -0.586 . . . . 71.01 111.788 -171.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 m -72.14 137.84 47.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.006 0.431 . . . . 71.42 110.9 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.08 144.31 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-N 116.372 -0.377 . . . . 73.25 111.876 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.8 t -95.3 176.44 6.21 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.915 0.388 . . . . 54.33 111.794 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -80.11 -29.87 39.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.943 0.401 . . . . 73.54 111.252 177.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.03 138.97 58.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.277 -0.42 . . . . 74.43 111.031 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.3 mt -101.81 147.93 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 112.059 0.392 . . . . 73.21 112.059 -175.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -94.74 -57.31 2.5 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 116.535 -0.302 . . . . 73.41 110.87 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -152.26 165.7 34.07 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.986 0.422 . . . . 73.11 111.857 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.514 ' HD3' HD11 ' A' ' 67' ' ' LEU . 64.9 mtt180 -128.8 137.66 51.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.932 0.396 . . . . 74.52 112.049 -172.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.4 m -113.57 132.49 55.7 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.369 -0.378 . . . . 73.33 111.936 -177.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.526 ' HH ' HD12 ' A' ' 61' ' ' ILE . 51.5 m-85 -109.6 157.67 18.8 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 120.774 0.321 . . . . 74.31 111.751 178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.4 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 55.3 m-20 -92.45 106.77 18.7 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.295 -0.411 . . . . 74.41 110.233 169.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.447 HD12 HG23 ' A' ' 59' ' ' VAL . 58.9 mt -115.45 134.08 55.43 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.146 0.498 . . . . 71.53 111.846 -178.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.96 128.74 40.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.162 -0.472 . . . . 72.41 111.003 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 61.5 p . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 112.479 0.548 . . . . 64.5 112.479 -175.761 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 121.412 0.625 . . . . 75.24 111.938 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.8 OUTLIER -87.72 125.12 34.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.449 -0.796 . . . . 74.03 110.86 176.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.489 HD11 HD12 ' A' ' 100' ' ' ILE . 27.0 pt -125.5 141.12 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.975 0.417 . . . . 75.03 111.823 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 22.1 mp0 -95.68 105.93 17.98 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.989 0.424 . . . . 64.2 111.325 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.447 HG23 HD12 ' A' ' 48' ' ' LEU . 93.4 t -100.01 128.47 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.652 0.263 . . . . 75.4 111.218 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.449 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 22.6 t -118.33 138.96 52.04 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.325 0.491 . . . . 74.43 112.325 -174.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.526 HD12 ' HH ' ' A' ' 46' ' ' TYR . 44.7 pt -133.76 149.01 70.74 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.282 -0.417 . . . . 71.25 111.109 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.44 145.48 94.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.433 2.089 . . . . 74.15 113.125 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -6.07 19.53 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.975 0.417 . . . . 64.42 112.073 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 55.3 p -74.02 -20.83 60.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.183 0.516 . . . . 74.34 110.679 172.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.6 t -89.78 124.8 62.93 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 115.849 -0.614 . . . . 73.2 110.864 177.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -49.73 126.42 16.44 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.813 2.342 . . . . 75.54 113.448 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.59 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 29.4 tp -56.75 126.32 26.34 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.074 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.483 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -69.72 -63.07 1.15 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.923 0.712 . . . . 74.34 112.923 -170.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.59 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 36.7 mt-10 56.25 45.61 22.79 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.757 0.651 . . . . 62.44 112.757 176.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -75.6 -169.17 0.98 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.824 0.345 . . . . 74.23 111.854 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -74.94 164.73 26.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.627 0.603 . . . . 73.21 112.627 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -70.92 125.4 26.73 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.863 -0.608 . . . . 72.11 111.113 -178.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 59.16 31.54 21.35 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 122.854 0.462 . . . . 72.04 111.878 -175.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.65 150.8 30.84 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.517 -0.31 . . . . 75.54 111.518 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.463 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 99.3 mtt180 -68.49 106.19 2.47 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.299 0.481 . . . . 73.12 112.299 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 35.7 m -123.2 141.65 42.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.422 -0.354 . . . . 75.34 111.095 174.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -128.82 164.71 22.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.333 0.587 . . . . 75.33 111.391 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.454 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.5 mt -102.24 136.65 41.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.968 -0.56 . . . . 62.41 112.025 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.556 HG22 ' ND2' ' A' ' 80' ' ' ASN . 49.7 mm -70.96 -76.14 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.184 -0.462 . . . . 73.54 111.417 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.556 ' ND2' HG22 ' A' ' 79' ' ' ILE . 44.8 m-80 -121.25 85.39 41.88 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.171 -0.33 . . . . 64.12 110.525 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -82.46 149.07 14.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.113 2.542 . . . . 74.34 114.703 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.7 pt -128.58 139.69 51.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.171 0.51 . . . . 74.1 110.122 168.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.66 105.75 17.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.286 -0.416 . . . . 71.52 111.859 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 121.293 0.568 . . . . 74.32 112.023 -179.861 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 . . . . . 0 C--O 1.236 0.39 0 CA-C-O 121.172 0.51 . . . . 72.32 112.238 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 76.2 m-85 -105.16 154.22 20.48 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.749 -0.66 . . . . 72.33 112.253 -177.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.489 HD12 HD11 ' A' ' 57' ' ' ILE . 66.7 mt -135.85 107.39 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.427 -0.806 . . . . 75.3 109.76 175.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.455 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.3 mtpp -86.13 120.88 27.99 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.363 0.601 . . . . 72.24 111.101 -177.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.09 144.33 43.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.098 0.475 . . . . 74.12 112.165 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -56.31 -44.38 79.84 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.895 -0.593 . . . . 73.15 111.133 173.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -165.34 158.09 15.82 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.162 -0.472 . . . . 75.33 110.95 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.483 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 23.8 mt -123.43 122.46 65.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.093 -0.503 . . . . 72.02 110.915 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.5 m -124.62 177.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.608 0.242 . . . . 71.21 111.261 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.4 mt -76.96 137.91 39.33 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 122.411 -0.181 . . . . 75.35 110.792 174.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 32.5 m . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 120.755 0.312 . . . . 73.21 111.296 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.3 mt . . . . . 0 N--CA 1.467 0.377 0 N-CA-C 110.291 -0.263 . . . . 72.21 110.291 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -127.84 133.47 49.38 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.146 0.498 . . . . 75.51 112.312 -178.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.49 ' HE1' ' HD2' ' A' ' 46' ' ' TYR . 65.7 t80 -77.84 114.75 17.0 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.719 -0.673 . . . . 74.45 111.555 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.7 m -97.39 -62.83 1.2 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.875 0.324 . . . . 64.33 111.875 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.21 171.08 20.85 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.465 0.543 . . . . 72.45 112.465 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -83.2 134.66 34.95 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.936 -0.574 . . . . 75.42 110.847 176.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -86.65 -58.74 2.49 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.646 0.26 . . . . 74.4 111.663 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -172.65 137.14 0.78 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.115 0.413 . . . . 72.32 112.115 -178.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -94.83 109.06 21.08 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.316 -0.402 . . . . 73.31 110.066 172.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.0 m -77.81 120.74 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 121.12 0.486 . . . . 72.35 111.31 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.452 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 62.6 mtm180 -104.44 -178.46 3.66 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.403 0.621 . . . . 73.54 112.293 -174.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.51 HG12 ' HE2' ' A' ' 42' ' ' LYS . 52.8 mt -99.42 118.85 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.909 -0.587 . . . . 71.32 111.806 -175.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.473 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 53.9 tt0 -85.51 118.19 24.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.055 0.455 . . . . 74.41 110.825 175.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.422 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.9 m-20 -74.29 167.54 21.42 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.959 0.725 . . . . 71.34 112.959 -172.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.49 -11.38 60.64 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.849 -0.614 . . . . 70.32 111.065 176.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -68.69 -32.02 71.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.281 0.562 . . . . 72.02 110.788 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.09 -33.26 5.11 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 115.859 -0.609 . . . . 71.12 111.952 -174.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.8 p -81.28 158.88 24.63 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.087 0.47 . . . . 64.03 111.27 176.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.473 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 38.3 t -93.66 125.02 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 120.712 0.291 . . . . 74.12 111.78 -177.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.422 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 41.0 t -65.77 152.71 43.7 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.094 0.473 . . . . 73.21 111.407 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.452 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 6.0 m-20 -77.45 -1.87 32.47 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.154 0.502 . . . . 61.13 111.064 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.9 142.48 45.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.137 -0.483 . . . . 73.03 110.682 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 62.5 mt -108.27 143.47 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.066 0.46 . . . . 74.45 112.079 -173.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.51 ' HE2' HG12 ' A' ' 30' ' ' ILE . 69.7 mmtt -88.29 -58.63 2.49 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.072 0.463 . . . . 73.54 110.616 171.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.478 ' CD ' ' HZ1' ' A' ' 101' ' ' LYS . 55.1 mt-10 -145.06 171.47 14.44 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.013 -0.539 . . . . 72.44 111.078 -177.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 45.7 ttm105 -134.07 114.81 13.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.435 -0.348 . . . . 64.12 111.386 -176.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.1 m -97.47 128.41 44.22 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.491 0.552 . . . . 73.03 112.491 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.49 ' HD2' ' HE1' ' A' ' 21' ' ' PHE . 80.1 m-85 -110.68 158.05 19.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.24 0.616 . . . . 74.45 111.365 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -99.94 107.22 19.14 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.525 -0.307 . . . . 74.43 110.484 170.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.9 mt -109.63 121.78 45.98 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.79 0.329 . . . . 74.23 110.849 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -76.05 144.39 40.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.07 0.462 . . . . 75.02 111.376 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 m . . . . . 0 N--CA 1.468 0.472 0 CA-C-N 116.075 -0.511 . . . . 72.51 111.222 -177.563 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.621 0.248 . . . . 65.44 110.46 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -95.67 -179.55 4.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.978 0.418 . . . . 75.53 111.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.512 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 30.7 pt -126.65 138.11 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 116.266 -0.424 . . . . 74.34 111.194 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -102.46 107.72 18.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.717 -0.614 . . . . 73.21 110.86 176.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 97.9 t -100.38 125.46 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.8 0.667 . . . . 74.31 112.8 -172.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -108.05 127.78 54.09 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.039 0.447 . . . . 74.11 111.315 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.4 HD11 ' HB ' ' A' ' 65' ' ' VAL . 37.0 pt -113.58 151.98 45.01 Favored Pre-proline 0 N--CA 1.473 0.675 0 CA-C-N 116.465 -0.334 . . . . 74.14 111.0 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.6 154.4 73.94 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.195 1.93 . . . . 72.42 112.766 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.58 -18.81 8.33 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.363 0.505 . . . . 75.41 112.363 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.2 m -60.89 -19.67 60.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.795 0.438 . . . . 73.22 111.998 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 24.2 t -114.48 120.02 38.77 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 116.666 -0.243 . . . . 75.13 110.893 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 16.7 Cg_exo -68.49 -172.43 0.45 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.033 2.489 . . . . 74.0 113.799 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.6 tp -72.1 147.41 46.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.049 -0.523 . . . . 75.5 111.092 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.468 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.9 mptp? -94.89 111.82 23.58 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.028 0.442 . . . . 75.22 111.388 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -80.74 65.03 5.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.205 0.526 . . . . 71.23 111.061 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -98.22 166.85 11.2 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.636 0.731 . . . . 70.31 112.304 -177.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.459 ' HB3' ' HB1' ' A' ' 74' ' ' ALA . 24.8 t70 -74.53 149.05 40.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.299 -0.864 . . . . 75.5 111.462 178.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.2 122.62 16.59 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.023 0.439 . . . . 75.44 111.642 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 64.07 30.23 13.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.1 0.56 . . . . 73.13 111.89 -177.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.459 ' HB1' ' HB3' ' A' ' 71' ' ' ASP . . . -80.59 151.33 29.14 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.719 0.295 . . . . 73.0 111.352 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -66.96 125.1 24.89 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.639 -0.255 . . . . 73.35 111.473 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.61 152.33 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 121.14 0.495 . . . . 73.22 112.007 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -137.69 169.52 17.64 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.858 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.5 mt -107.79 155.02 20.69 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.714 0.769 . . . . 72.34 113.053 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.5 mm -111.2 116.28 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 115.156 -0.929 . . . . 74.1 109.522 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 53.84 75.46 0.62 Allowed Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 122.645 0.378 . . . . 74.0 111.917 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.58 130.82 7.07 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.68 2.253 . . . . 62.21 114.104 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.463 HG13 ' HB2' ' A' ' 101' ' ' LYS . 48.7 pt -132.68 161.01 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.355 -0.384 . . . . 73.42 110.909 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.85 140.52 37.01 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.806 -0.558 . . . . 60.34 111.303 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 . . . . . 0 CA--C 1.547 0.858 0 CA-C-O 120.952 0.406 . . . . 74.33 110.989 -177.835 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.512 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 122.538 1.161 . . . . 74.35 114.027 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -95.72 113.02 24.62 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.031 -1.441 . . . . 75.42 111.512 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 9.9 mt -96.11 165.46 2.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.544 -0.909 . . . . 74.22 108.544 172.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.478 ' HZ1' ' CD ' ' A' ' 43' ' ' GLU . 28.5 mtpt -140.27 163.84 31.69 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.567 -0.708 . . . . 74.45 110.762 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -154.34 156.01 36.13 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.054 0.454 . . . . 63.44 111.87 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -74.94 -21.96 58.87 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.061 -0.518 . . . . 73.52 110.29 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -171.24 160.88 6.41 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.168 0.509 . . . . 54.21 111.482 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.468 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 38.5 mt -127.34 123.59 62.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.154 -0.475 . . . . 72.23 110.814 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.3 m -128.75 -179.43 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 122.411 0.284 . . . . 73.4 111.125 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 98.0 mt -78.41 144.17 36.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.757 0.313 . . . . 71.41 111.142 176.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 120.924 0.392 . . . . 62.4 111.407 -179.301 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt . . . . . 0 CA--C 1.537 0.481 0 N-CA-C 110.303 -0.258 . . . . 75.21 110.303 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -123.23 114.73 20.65 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.844 -0.535 . . . . 74.33 111.607 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -63.75 132.12 49.99 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.258 0.466 . . . . 71.12 112.258 -176.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.9 t -109.15 -65.01 1.18 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.131 0.419 . . . . 73.33 112.131 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.49 173.68 15.21 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.117 0.484 . . . . 63.21 112.06 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.2 tp -88.37 117.28 27.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.318 -0.401 . . . . 74.25 110.411 173.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -72.69 -62.38 1.47 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.969 0.414 . . . . 74.13 112.026 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -170.1 143.7 2.52 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.058 -0.519 . . . . 64.11 111.562 -175.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.0 mt-10 -105.23 103.66 13.24 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.375 -0.602 . . . . 65.51 109.375 170.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.518 HG23 ' HB2' ' A' ' 42' ' ' LYS . 15.9 m -67.25 102.03 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.587 0.708 . . . . 71.1 110.876 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.754 ' HG2' HG12 ' A' ' 41' ' ' ILE . 98.9 mtt180 -98.52 158.31 15.68 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.719 0.637 . . . . 74.03 112.719 -171.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.426 HG12 ' HZ1' ' A' ' 42' ' ' LYS . 66.5 mt -69.02 109.3 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.586 -0.733 . . . . 74.43 112.076 -175.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.444 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.0 tt0 -86.85 124.52 33.17 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.904 0.383 . . . . 74.22 110.332 174.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -70.43 155.44 40.69 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.795 0.331 . . . . 73.41 111.728 -178.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -23.71 62.72 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.407 0.623 . . . . 74.31 110.666 169.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.1 -28.06 64.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.652 -0.704 . . . . 71.04 111.499 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.81 -36.6 4.02 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 116.26 -0.427 . . . . 50.32 112.456 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.3 p -71.33 150.64 44.92 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 75.4 111.817 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 22.8 t -92.37 145.92 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.158 -0.474 . . . . 73.03 111.078 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.2 t -101.7 163.4 12.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.111 0.482 . . . . 74.2 111.835 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -77.54 -18.1 57.3 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.986 -0.552 . . . . 64.23 111.141 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.72 132.1 45.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.279 -0.419 . . . . 73.04 110.086 173.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.754 HG12 ' HG2' ' A' ' 29' ' ' ARG . 26.2 mt -109.84 147.47 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 112.069 0.396 . . . . 74.41 112.069 -169.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.518 ' HB2' HG23 ' A' ' 28' ' ' VAL . 39.7 mmtm -74.56 -61.06 2.0 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.416 -0.587 . . . . 72.13 109.416 169.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -155.26 167.23 31.05 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.384 -0.825 . . . . 63.35 110.022 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.445 ' HD3' ' OH ' ' A' ' 46' ' ' TYR . 4.3 ptp85 -122.7 133.72 54.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.161 0.505 . . . . 75.11 112.157 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.5 m -107.52 124.93 50.63 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.858 -0.61 . . . . 74.15 112.474 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.445 ' OH ' ' HD3' ' A' ' 44' ' ' ARG . 79.7 m-85 -110.81 153.66 25.05 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 122.88 0.472 . . . . 75.12 111.143 176.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.64 114.33 26.25 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.06 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.519 HD12 HG23 ' A' ' 59' ' ' VAL . 47.4 mt -114.21 132.34 56.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.569 0.7 . . . . 73.5 111.77 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.574 ' HZ3' ' HB3' ' A' ' 49' ' ' LYS . 2.6 mmmp? -93.28 150.99 20.07 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.557 -0.747 . . . . 73.2 111.16 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.2 m . . . . . 0 N--CA 1.472 0.647 0 CA-C-O 120.871 0.367 . . . . 71.32 111.802 179.772 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 55' ' ' ARG . 36.9 mtt180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 121.086 0.469 . . . . 75.22 111.119 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.9 ttt -128.43 148.63 50.72 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.975 -0.557 . . . . 65.11 110.763 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 pt -135.48 135.44 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.918 0.389 . . . . 73.35 111.28 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -98.11 105.73 17.92 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.109 0.48 . . . . 62.31 110.494 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.519 HG23 HD12 ' A' ' 48' ' ' LEU . 70.1 t -94.41 129.98 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.343 -0.389 . . . . 74.32 111.715 -174.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 101' ' ' LYS . 39.9 m -118.38 141.82 48.15 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.944 0.402 . . . . 73.55 111.292 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.1 pt -131.24 150.97 78.0 Favored Pre-proline 0 CA--C 1.539 0.525 0 O-C-N 122.305 -0.247 . . . . 72.3 110.928 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HG2' HG22 ' A' ' 65' ' ' VAL . 12.2 Cg_endo -55.76 146.13 68.09 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.481 2.12 . . . . 73.22 112.974 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.49 -28.49 59.94 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.678 0.621 . . . . 62.2 112.678 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.0 m -62.23 -26.5 68.41 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.079 0.4 . . . . 63.41 112.079 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.471 HG22 ' HG2' ' A' ' 62' ' ' PRO . 51.0 t -79.01 125.05 84.48 Favored Pre-proline 0 CA--C 1.544 0.723 0 CA-C-N 116.841 -0.163 . . . . 74.32 110.996 179.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -64.73 161.35 36.3 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.408 . . . . 73.2 114.416 -174.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.7 tp -67.61 138.16 56.19 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.835 -0.621 . . . . 73.04 111.224 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.442 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.4 mptp? -81.84 -48.98 10.89 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.266 0.839 . . . . 74.42 113.266 -173.695 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 63.77 21.59 12.73 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.834 0.679 . . . . 73.13 112.834 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -64.66 159.5 21.9 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.009 0.433 . . . . 71.41 111.865 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.515 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 4.9 m-20 -68.06 154.22 42.1 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.409 0.623 . . . . 72.11 112.512 -177.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -65.02 133.53 51.88 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.718 -0.673 . . . . 73.43 111.178 174.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 63.3 19.54 11.74 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.189 0.596 . . . . 73.1 112.481 -177.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -82.22 153.65 25.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.156 0.428 . . . . 71.25 112.156 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.528 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 65.4 mtt85 -70.77 104.35 2.86 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.954 -0.566 . . . . 73.54 112.111 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.435 HG11 HD22 ' A' ' 107' ' ' LEU . 31.8 m -120.13 153.06 23.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.099 -0.5 . . . . 75.13 111.273 177.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.402 ' HB3' ' HG1' ' A' ' 108' ' ' THR . 9.4 pt-20 -145.92 173.49 12.1 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.131 0.491 . . . . 75.45 111.064 176.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.458 HD23 HG12 ' A' ' 59' ' ' VAL . 81.8 mt -112.18 132.17 55.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.061 0.457 . . . . 72.02 111.981 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.583 HG21 ' ND2' ' A' ' 80' ' ' ASN . 48.5 mm -65.04 -59.54 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 115.916 -0.584 . . . . 72.42 111.337 178.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.583 ' ND2' HG21 ' A' ' 79' ' ' ILE . 47.5 m-80 -130.41 87.41 50.53 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 122.388 -0.195 . . . . 75.42 110.936 174.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.34 140.4 10.87 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.219 2.612 . . . . 71.32 114.509 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.8 pt -136.11 149.57 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 120.828 0.347 . . . . 64.13 110.858 172.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.35 117.36 29.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.579 0.228 . . . . 64.54 111.097 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 113.527 0.936 . . . . 72.53 113.527 -173.262 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 113.537 0.94 . . . . 75.15 113.537 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.03 148.41 41.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.954 -1.021 . . . . 71.44 111.64 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 65.1 mt -129.01 115.04 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.106 -0.497 . . . . 53.14 110.24 177.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 60' ' ' SER . 45.7 mtpt -89.98 136.14 33.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 74.3 111.813 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.13 153.29 43.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.339 0.59 . . . . 71.43 112.068 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.539 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.6 t70 -63.94 -40.66 96.95 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.309 0.576 . . . . 72.14 111.028 173.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -165.22 158.49 16.5 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.742 -0.663 . . . . 72.53 111.112 179.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . 0.442 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 39.2 mt -119.01 123.23 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.136 -0.484 . . . . 73.12 111.25 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 36.0 m -128.12 -179.8 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 120.781 0.324 . . . . 73.11 111.75 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . 0.435 HD22 HG11 ' A' ' 76' ' ' VAL . 87.5 mt -91.58 138.16 31.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 75.32 111.435 177.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.528 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 8.3 m . . . . . 0 N--CA 1.47 0.567 0 CA-C-N 116.046 -0.525 . . . . 70.31 111.452 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 tpt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 121.049 0.452 . . . . 75.14 111.641 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -167.81 139.06 2.92 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.913 -0.585 . . . . 74.14 109.737 174.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -90.65 122.5 33.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.381 0.61 . . . . 74.34 111.776 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -98.62 133.22 43.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.719 -0.673 . . . . 73.2 111.014 177.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.26 119.57 7.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.29 -0.414 . . . . 71.02 111.688 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -85.19 -2.85 58.49 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.933 0.397 . . . . 71.22 111.807 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.44 -146.59 4.37 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 121.27 -0.491 . . . . 73.25 112.992 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 pt -108.35 146.45 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 121.01 0.433 . . . . 75.21 111.688 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.6 t -72.52 -54.34 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.149 0.499 . . . . 64.5 110.807 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.06 168.08 18.0 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.131 -0.486 . . . . 71.05 110.776 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -106.99 148.5 28.6 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.618 0.246 . . . . 74.44 110.924 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HE2' ' OG1' ' A' ' 14' ' ' THR . 23.4 pttm -125.13 145.07 50.11 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.851 0.358 . . . . 74.02 111.218 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -89.11 13.94 11.94 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.224 0.453 . . . . 64.41 112.224 -176.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.5 ' OG1' ' HE2' ' A' ' 12' ' ' LYS . 58.0 p -63.61 -23.23 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.049 0.452 . . . . 72.25 111.529 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -68.47 -5.49 19.65 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.12 -0.491 . . . . 74.44 111.987 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.4 t80 72.12 -64.95 0.37 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.745 0.783 . . . . 72.02 110.375 177.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -166.65 -112.18 0.26 Allowed Glycine 0 CA--C 1.519 0.341 0 N-CA-C 109.511 -1.436 . . . . 73.4 109.511 173.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -103.86 106.51 17.04 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.352 -0.61 . . . . 73.42 109.352 161.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 93.4 mt -95.48 108.75 21.0 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.598 -0.519 . . . . 72.51 109.598 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 59.1 mtmt -124.26 134.8 53.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.255 0.55 . . . . 73.43 111.689 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.79 144.36 57.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.404 -0.816 . . . . 73.53 113.012 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 71.7 m -123.55 -62.43 1.31 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.132 -0.485 . . . . 74.33 111.33 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.16 179.68 8.8 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.161 0.505 . . . . 75.13 111.916 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.2 tp -101.94 101.32 11.72 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.485 -0.561 . . . . 73.44 109.485 170.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.489 ' HG2' ' OE1' ' A' ' 58' ' ' GLN . 10.4 tpp180 -58.3 -58.82 6.8 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.225 0.454 . . . . 73.15 112.225 -173.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -169.14 135.21 1.67 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.84 0.353 . . . . 74.11 111.73 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -98.82 98.14 9.27 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 110.006 -0.368 . . . . 70.42 110.006 174.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.49 135.84 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.805 0.336 . . . . 53.41 110.75 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.476 ' HG2' HD12 ' A' ' 41' ' ' ILE . 80.7 mtt180 -116.68 170.25 8.73 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.476 0.655 . . . . 75.45 112.742 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -75.1 113.65 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 115.577 -0.738 . . . . 75.34 111.385 -175.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.506 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -83.56 133.83 34.85 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.934 0.397 . . . . 70.45 111.932 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -80.6 150.25 29.58 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.544 -0.298 . . . . 61.43 110.858 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.22 -34.67 70.66 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.866 0.365 . . . . 65.51 111.97 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.53 -27.62 66.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.302 -0.408 . . . . 74.11 111.975 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.26 -57.52 0.64 Allowed Glycine 0 CA--C 1.524 0.64 0 C-N-CA 120.827 -0.701 . . . . 53.01 113.042 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.1 m -62.96 149.79 43.87 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.428 0.633 . . . . 72.14 112.375 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 39.5 t -90.94 147.55 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.979 -0.555 . . . . 72.32 111.228 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -81.31 174.54 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.574 0.702 . . . . 72.52 112.123 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -88.23 -10.4 49.87 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.535 -0.757 . . . . 72.13 111.225 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 29' ' ' ARG . 21.9 mm-40 -81.89 144.04 31.25 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.125 0.488 . . . . 71.23 111.871 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.476 HD12 ' HG2' ' A' ' 29' ' ' ARG . 20.7 mm -85.08 153.43 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.945 -0.571 . . . . 73.41 112.323 -172.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -113.9 -58.17 2.18 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 116.343 -0.39 . . . . 72.54 110.107 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -141.13 160.46 40.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.051 0.54 . . . . 72.45 110.825 172.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 44' ' ' ARG . 37.7 mtt180 -119.05 117.46 28.82 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.595 0.236 . . . . 75.45 110.899 178.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.0 m -96.2 121.35 37.89 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 111.91 0.337 . . . . 73.2 111.91 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.491 ' HH ' HD12 ' A' ' 61' ' ' ILE . 55.8 m-85 -108.47 153.92 22.64 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.235 0.541 . . . . 75.12 112.021 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -97.0 112.58 24.27 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.757 -0.656 . . . . 74.55 110.716 174.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.647 HD12 HG23 ' A' ' 59' ' ' VAL . 81.4 mt -123.66 137.42 54.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.691 0.282 . . . . 71.53 111.19 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.52 140.46 32.73 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.763 0.316 . . . . 75.2 110.418 174.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.7 p -130.94 149.42 52.57 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.131 0.491 . . . . 73.12 111.486 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -79.83 121.65 25.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.324 -0.398 . . . . 72.31 111.43 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.28 -98.3 0.15 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 121.086 -0.578 . . . . 64.35 113.068 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -92.67 -1.39 56.9 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.048 0.388 . . . . 64.02 112.048 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 77.37 34.99 38.72 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 121.206 -0.521 . . . . 55.31 113.567 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -110.88 129.11 55.96 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.296 0.48 . . . . 73.5 112.296 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.4 ptp -72.92 118.69 16.17 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.234 -0.439 . . . . 72.51 109.983 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.9 pt -94.74 138.08 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-O 120.996 0.426 . . . . 71.41 111.947 -173.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.489 ' OE1' ' HG2' ' A' ' 25' ' ' ARG . 25.2 mm-40 -93.16 104.71 16.88 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.24 -0.436 . . . . 75.55 110.977 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.647 HG23 HD12 ' A' ' 48' ' ' LEU . 81.0 t -98.49 116.16 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-O 120.875 0.369 . . . . 73.23 111.481 -177.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.9 t -111.06 123.93 51.16 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.872 0.368 . . . . 43.11 111.697 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.491 HD12 ' HH ' ' A' ' 46' ' ' TYR . 32.0 pt -115.31 147.06 37.79 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.328 -0.396 . . . . 73.22 110.944 176.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.95 157.61 51.83 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 122.325 2.017 . . . . 73.21 113.698 -177.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.01 -33.27 66.99 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.879 0.696 . . . . 73.22 112.879 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 58.4 m -58.32 -19.42 34.83 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.737 0.303 . . . . 63.04 111.721 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.9 t -91.31 126.07 56.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-N 116.545 -0.298 . . . . 73.22 110.829 177.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.78 162.1 43.38 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.406 2.07 . . . . 72.23 113.149 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 52.6 tp -72.42 142.33 48.67 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.202 -0.454 . . . . 75.53 111.183 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 105' ' ' ILE . 0.2 OUTLIER -111.02 106.72 15.89 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.259 0.552 . . . . 74.33 111.475 177.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -74.79 74.87 2.1 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.72 -0.673 . . . . 74.11 111.568 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -94.67 154.43 17.33 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.967 0.413 . . . . 71.1 112.009 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.3 170.47 16.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.005 0.431 . . . . 63.45 111.671 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -67.75 129.95 41.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.043 0.449 . . . . 62.34 111.687 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 90.3 m-20 69.42 18.31 7.91 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.604 0.762 . . . . 64.11 113.028 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.38 132.66 52.2 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.193 -0.317 . . . . 73.12 110.958 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.1 mtm180 -76.36 118.67 19.3 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.025 0.44 . . . . 74.01 111.932 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.516 HG11 HD21 ' A' ' 107' ' ' LEU . 34.0 m -124.75 161.38 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.999 -0.546 . . . . 71.52 111.489 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -138.49 147.23 42.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.125 0.488 . . . . 72.21 110.311 171.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.9 mt -97.81 137.49 36.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.308 -0.405 . . . . 74.22 112.035 -173.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.5 mm -63.57 -71.16 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 CA-C-N 116.12 -0.491 . . . . 75.21 111.413 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.451 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 92.4 m-20 -122.75 82.96 48.95 Favored Pre-proline 0 N--CA 1.473 0.694 0 CA-C-O 120.667 0.27 . . . . 70.33 111.438 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -82.43 132.2 6.81 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.977 2.451 . . . . 73.44 113.574 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.5 pt -136.91 125.71 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 120.858 0.361 . . . . 74.4 111.492 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.02 114.11 18.68 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.302 -0.259 . . . . 75.23 110.302 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -90.79 173.09 8.19 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.604 0.716 . . . . 75.43 112.495 -170.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.434 ' O ' HG21 ' A' ' 85' ' ' THR . 20.2 m -129.99 13.41 5.74 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.528 -0.76 . . . . 73.42 109.946 171.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -83.37 -32.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 116.283 -0.417 . . . . 74.14 111.534 -177.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.56 -56.87 9.96 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.04 0.448 . . . . 75.31 110.73 175.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p -65.53 -7.2 13.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.011 -0.54 . . . . 74.22 112.194 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -85.16 -24.46 27.94 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.825 0.306 . . . . 62.31 111.825 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.8 t -108.98 -21.62 12.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.891 0.33 . . . . 75.1 111.891 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -101.71 158.47 16.08 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.884 0.374 . . . . 73.3 111.072 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -154.44 120.79 5.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.033 0.444 . . . . 75.54 111.175 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 94.49 -30.52 7.7 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 121.134 -0.555 . . . . 72.13 112.923 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.69 -22.51 34.52 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.91 0.386 . . . . 73.33 111.651 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.7 82.19 1.57 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.46 . . . . 71.32 111.543 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -84.99 -28.47 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.326 -0.397 . . . . 74.1 111.557 177.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -126.3 167.26 15.73 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.69 0.281 . . . . 73.33 110.689 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -95.22 150.84 19.79 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.253 0.549 . . . . 74.05 112.329 -174.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -107.48 137.85 44.77 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.622 0.725 . . . . 74.51 112.318 -171.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.426 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 52.7 mt -126.68 109.16 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.567 -0.742 . . . . 71.54 110.716 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -82.73 129.2 34.93 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 122.138 -0.351 . . . . 73.54 110.493 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.9 167.39 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.289 0.566 . . . . 61.52 112.355 -174.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 31.3 t70 -86.68 -62.04 1.6 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.763 -0.653 . . . . 64.42 111.235 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -145.59 155.03 42.79 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.127 0.489 . . . . 71.02 111.122 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.429 ' O ' ' NZ ' ' A' ' 68' ' ' LYS . 71.0 mt -111.81 115.07 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 115.734 -0.666 . . . . 74.44 111.577 -178.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.32 172.23 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 120.549 0.214 . . . . 65.25 111.055 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.516 HD21 HG11 ' A' ' 76' ' ' VAL . 96.2 mt -83.15 150.0 26.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 122.284 -0.26 . . . . 74.32 110.892 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.1 m -62.63 105.86 0.7 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.762 0.315 . . . . 75.4 111.345 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.408 ' H ' HD22 ' A' ' 109' ' ' LEU . 0.5 OUTLIER -86.3 -11.93 50.85 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.533 0.568 . . . . 73.44 112.533 -174.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.743 -0.646 . . . . 74.11 112.048 179.618 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 120.845 0.355 . . . . 72.21 111.57 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 64.9 mtt -132.91 153.01 51.79 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.581 0.353 . . . . 75.52 110.764 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.449 ' N ' ' HD2' ' A' ' 3' ' ' ARG . 7.8 mpt_? -96.84 125.11 41.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.855 0.359 . . . . 73.23 111.184 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -95.1 139.39 31.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.064 0.459 . . . . 75.45 110.911 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.27 165.69 19.16 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.272 0.558 . . . . 72.24 112.148 -177.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -72.66 153.33 41.26 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.843 -0.617 . . . . 73.12 111.452 -178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.73 89.88 0.12 Allowed Glycine 0 CA--C 1.526 0.771 0 C-N-CA 121.3 -0.476 . . . . 51.42 112.718 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 34.1 pt -91.65 176.16 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 112.59 0.589 . . . . 74.42 112.59 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 45.2 t -80.84 143.26 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 73.35 111.497 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 pp -140.29 170.1 16.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.422 -0.354 . . . . 74.2 111.374 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.35 107.23 0.87 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 61.11 111.852 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -115.7 122.75 46.46 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.282 -0.417 . . . . 74.33 111.008 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.9 t70 62.59 83.93 0.15 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.356 0.598 . . . . 72.0 110.867 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.8 p -94.41 -83.69 0.34 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.639 0.607 . . . . 73.1 112.639 -175.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.428 ' O ' HG21 ' A' ' 15' ' ' THR . 6.4 m -86.7 16.85 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.073 0.463 . . . . 71.54 111.524 -177.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 63.11 -179.5 0.15 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.381 0.61 . . . . 71.33 112.218 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -98.32 -145.14 18.27 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.207 -0.521 . . . . 52.43 112.059 174.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.58 124.88 37.87 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.732 0.777 . . . . 71.31 110.855 175.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.4 mt -89.15 159.22 17.6 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.466 -0.788 . . . . 71.24 111.965 -171.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.556 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 11.1 mptt -116.62 115.67 26.14 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.855 0.36 . . . . 74.41 111.506 178.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -66.8 126.77 30.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.231 -0.44 . . . . 72.44 111.154 177.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.544 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 82.0 p -106.83 -63.51 1.27 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.949 0.351 . . . . 72.4 111.949 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.92 176.61 12.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.345 0.593 . . . . 74.51 112.087 -177.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.431 HD23 ' HG3' ' A' ' 27' ' ' GLU . 61.1 tp -83.16 117.81 23.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.985 -0.552 . . . . 75.31 111.101 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -69.07 -66.81 0.53 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.939 0.399 . . . . 75.44 111.363 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -168.25 131.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.061 0.458 . . . . 73.12 111.745 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.431 ' HG3' HD23 ' A' ' 24' ' ' LEU . 47.2 mt-10 -96.8 99.37 10.95 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.315 -0.402 . . . . 64.53 110.058 173.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m -74.34 118.98 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.281 0.562 . . . . 74.34 111.516 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HG2' HG12 ' A' ' 41' ' ' ILE . 96.3 mtt180 -96.54 164.36 12.64 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.443 0.64 . . . . 72.31 112.291 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.88 111.19 13.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 115.793 -0.64 . . . . 71.53 111.041 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 61.6 tt0 -82.75 147.11 28.62 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.053 0.454 . . . . 75.13 111.617 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -90.93 166.94 12.78 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.924 0.392 . . . . 64.23 110.477 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.39 -24.73 57.25 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 122.131 -0.356 . . . . 74.53 111.678 -178.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -80.91 32.27 0.32 Allowed 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 111.965 0.357 . . . . 71.24 111.965 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.45 -48.08 3.75 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 114.182 0.433 . . . . 71.21 114.182 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 m -66.79 145.3 55.65 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.236 0.541 . . . . 74.05 112.428 -177.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.502 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.5 t -96.29 140.65 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.018 -0.537 . . . . 75.32 111.161 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -75.65 171.68 13.9 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.313 0.578 . . . . 71.34 111.293 178.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.3 -18.3 32.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 55.4 110.707 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.38 137.62 57.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.624 -0.716 . . . . 55.12 110.603 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.605 HG12 ' HG2' ' A' ' 29' ' ' ARG . 32.4 mt -104.46 142.57 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 121.179 0.514 . . . . 75.44 111.377 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.55 -57.78 2.38 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.274 -0.421 . . . . 72.33 111.043 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.41 ' HB3' ' OG ' ' A' ' 60' ' ' SER . 61.7 mt-10 -137.46 148.48 46.13 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 120.992 0.425 . . . . 75.21 111.688 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -110.2 111.58 23.0 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.357 -0.383 . . . . 73.14 111.166 176.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.4 m -101.46 124.16 46.69 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.393 0.516 . . . . 72.15 112.393 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.549 ' HH ' HD11 ' A' ' 67' ' ' LEU . 54.2 m-85 -115.83 160.58 19.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.905 0.482 . . . . 72.31 111.045 177.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -101.12 125.61 47.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.714 0.292 . . . . 43.4 111.67 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.527 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -123.52 134.37 53.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-O 120.795 0.331 . . . . 71.21 111.722 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.544 ' HE2' ' HB3' ' A' ' 22' ' ' SER . 3.8 mptp? -80.77 147.25 30.59 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.98 0.419 . . . . 74.23 111.313 173.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -83.1 166.79 18.42 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.083 -0.508 . . . . 72.42 110.507 174.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.72 0.55 6.81 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.369 0.507 . . . . 75.12 112.369 178.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 142.5 27.48 0.16 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 121.013 -0.613 . . . . 61.03 113.917 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -91.35 -0.75 57.7 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.048 0.424 . . . . 74.14 111.832 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.2 35.85 90.99 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.35 -0.452 . . . . 72.14 113.563 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 55' ' ' ARG . 5.3 ptp180 -140.82 137.07 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.975 0.417 . . . . 74.45 111.933 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 43.1 ttm -96.88 110.43 22.94 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.133 -0.485 . . . . 74.11 109.701 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 26.8 pt -95.1 127.97 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 121.026 0.441 . . . . 73.14 111.176 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 77.3 mt-30 -93.65 105.82 17.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.378 0.608 . . . . 71.03 110.656 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.527 HG21 HD12 ' A' ' 48' ' ' LEU . 84.0 t -94.82 122.53 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 115.988 -0.551 . . . . 74.55 111.986 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.708 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 24.5 t -114.35 130.21 56.67 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.968 0.413 . . . . 75.34 111.377 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 pt -120.36 156.2 55.54 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 116.315 -0.402 . . . . 74.0 110.982 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.35 125.75 19.44 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.452 2.101 . . . . 71.33 112.392 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.5 39.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.016 0.747 . . . . 73.41 113.016 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.0 t -56.82 -30.76 64.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.058 0.456 . . . . 54.13 111.519 175.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.4 t -78.75 133.88 61.75 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 116.069 -0.514 . . . . 72.24 111.328 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.49 158.01 4.41 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.379 2.719 . . . . 75.52 114.476 -178.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.549 HD11 ' HH ' ' A' ' 46' ' ' TYR . 58.6 tp -68.14 145.81 54.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.254 -0.885 . . . . 74.11 111.767 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -90.12 126.03 35.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.254 0.549 . . . . 71.45 111.88 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -107.65 25.78 11.09 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.661 -0.7 . . . . 73.25 111.592 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -62.19 153.45 30.3 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.208 0.528 . . . . 75.21 112.087 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -80.97 164.71 22.35 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.894 -0.594 . . . . 65.12 112.267 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -59.12 118.08 5.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.065 -0.516 . . . . 74.4 111.614 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.515 ' N ' HD21 ' A' ' 73' ' ' ASN . 0.8 OUTLIER 68.31 24.25 7.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.55 0.74 . . . . 73.42 112.216 -178.639 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.79 133.92 50.06 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.765 0.317 . . . . 73.53 111.3 176.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.556 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 75.5 mtm180 -74.63 113.49 11.95 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.116 0.484 . . . . 73.44 111.682 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.495 HG11 HD22 ' A' ' 107' ' ' LEU . 35.0 m -126.16 153.99 35.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.284 0.564 . . . . 73.31 111.999 -177.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.403 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.4 pt-20 -128.01 154.72 45.31 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.126 -0.488 . . . . 75.44 110.268 173.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.35 146.67 24.54 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.168 0.803 . . . . 74.43 113.168 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.72 112.49 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 115.336 -0.847 . . . . 73.22 110.036 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 58.78 62.01 4.59 Favored Pre-proline 0 CA--C 1.547 0.864 0 N-CA-C 112.023 0.379 . . . . 62.14 112.023 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -81.66 140.45 11.75 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.817 2.345 . . . . 75.1 113.8 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.44 147.23 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-O 120.945 0.402 . . . . 74.42 111.099 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.35 108.16 16.35 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.916 0.389 . . . . 72.03 110.693 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -80.76 98.11 7.62 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.214 0.53 . . . . 62.03 111.564 -174.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.8 p -73.46 -28.09 61.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.017 -0.538 . . . . 75.51 112.146 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.5 m -73.86 -15.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 112.265 0.469 . . . . 72.24 112.265 -177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.45 -59.34 4.7 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.739 0.274 . . . . 63.13 111.739 176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 t -62.57 -28.06 69.61 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 120.98 0.419 . . . . 71.4 111.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.27 60.31 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.845 0.355 . . . . 73.14 111.519 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 52.4 m -96.25 -41.09 8.84 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.847 0.356 . . . . 73.42 111.927 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -118.18 93.82 4.27 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.635 -0.257 . . . . 73.54 111.59 -176.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -77.46 143.49 38.5 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.003 0.43 . . . . 75.3 110.991 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 105.62 7.75 36.18 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 121.122 -0.561 . . . . 63.21 112.648 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -150.79 32.79 0.61 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.689 0.757 . . . . 73.21 109.566 176.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -75.68 -45.68 35.59 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.797 -1.092 . . . . 73.22 112.998 -168.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.08 -32.56 48.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 N-CA-C 112.798 0.666 . . . . 71.01 112.798 -172.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -88.4 80.97 7.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.544 0.688 . . . . 75.14 110.322 175.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 148.33 16.51 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 114.352 1.241 . . . . 74.13 114.352 -174.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -104.39 120.75 41.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.406 -1.27 . . . . 75.13 111.818 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.499 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 56.4 mt -99.59 107.18 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.219 -0.446 . . . . 74.31 109.968 175.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.708 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 58.7 mtpt -94.06 129.14 40.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.15 0.5 . . . . 73.33 111.942 -175.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.48 174.7 7.62 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.991 0.425 . . . . 71.42 111.467 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.23 -37.05 26.56 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.952 0.406 . . . . 71.2 110.787 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -161.01 164.93 30.6 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 116.316 -0.402 . . . . 73.32 111.502 177.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 44.2 mt -122.56 118.39 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 116.494 -0.321 . . . . 73.35 110.815 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.38 167.13 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 120.793 0.33 . . . . 74.11 111.652 -177.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.495 HD22 HG11 ' A' ' 76' ' ' VAL . 95.0 mt -70.74 144.13 51.03 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.649 0.262 . . . . 71.23 111.123 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.403 ' HA ' ' HG2' ' A' ' 77' ' ' GLU . 57.8 m -63.54 121.6 14.26 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.837 0.351 . . . . 64.31 111.881 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.01 94.26 0.23 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.164 -0.471 . . . . 75.02 111.635 178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 118.942 -0.551 . . . . 74.4 111.18 177.367 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.63 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 111.787 0.292 . . . . 61.4 111.787 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.477 ' HG2' ' HG2' ' A' ' 1' ' ' MET . 25.2 ptt? -176.54 133.49 0.22 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.812 0.339 . . . . 75.43 110.855 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.0 mtp180 -103.9 139.49 38.99 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.902 0.382 . . . . 73.41 111.57 -177.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.0 mm? -101.3 176.79 5.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.851 0.357 . . . . 75.23 110.795 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.27 -21.55 62.95 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.999 0.428 . . . . 75.23 111.965 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -69.83 112.67 6.43 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.451 -0.341 . . . . 71.13 111.903 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.74 -76.77 0.79 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 121.365 -0.445 . . . . 40.35 112.57 175.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.6 pt -105.97 158.53 6.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 74.1 111.742 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.5 t -130.76 118.78 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.366 -0.379 . . . . 65.33 110.565 177.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -65.15 166.9 8.88 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.065 0.459 . . . . 75.31 111.713 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -100.78 -60.27 1.55 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.465 -0.334 . . . . 71.42 111.732 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -174.45 102.41 0.1 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.951 0.405 . . . . 74.21 110.692 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -74.4 -18.13 60.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.563 0.579 . . . . 74.44 112.563 -176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.1 p -71.14 95.36 1.23 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.334 0.588 . . . . 75.31 111.367 179.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.0 p -59.84 -14.08 13.47 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.752 0.649 . . . . 71.54 112.752 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.425 ' HA ' HE22 ' A' ' 53' ' ' GLN . 64.8 m-85 -85.9 -0.29 55.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.657 0.265 . . . . 74.35 111.523 177.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.42 -143.92 29.97 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 121.215 -0.517 . . . . 54.44 111.81 -172.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.415 ' H ' ' HB3' ' A' ' 51' ' ' LYS . 1.7 mp0 -87.76 131.22 34.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 117.306 0.553 . . . . 73.02 110.57 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -85.33 127.45 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.813 0.34 . . . . 75.31 110.174 175.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 56.9 mtmt -123.71 117.22 24.45 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.258 0.551 . . . . 72.3 111.978 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.7 157.46 9.35 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.948 -1.024 . . . . 74.51 113.03 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.487 ' OG ' ' HE3' ' A' ' 49' ' ' LYS . 33.9 m -134.14 -65.22 0.66 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.208 0.448 . . . . 64.24 112.208 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.52 -179.29 7.53 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.222 0.534 . . . . 70.24 112.307 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.415 HD23 ' HG3' ' A' ' 27' ' ' GLU . 59.0 tp -88.29 120.08 29.32 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.833 -0.621 . . . . 72.51 110.308 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -76.37 -55.31 5.66 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.982 0.42 . . . . 74.42 111.421 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -173.57 131.74 0.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.141 -0.482 . . . . 75.42 111.003 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.415 ' HG3' HD23 ' A' ' 24' ' ' LEU . 37.7 mt-10 -90.83 98.63 11.89 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.721 -0.474 . . . . 60.42 109.721 171.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.4 m -67.27 119.22 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.33 0.586 . . . . 74.44 111.284 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.499 ' HG2' HG12 ' A' ' 41' ' ' ILE . 56.5 mtt180 -98.48 167.91 10.52 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.378 0.609 . . . . 72.22 112.081 -175.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -83.07 100.22 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.842 -0.617 . . . . 74.24 112.041 -172.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.55 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 60.9 tt0 -79.41 120.74 24.26 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.482 -0.326 . . . . 75.34 110.961 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -67.46 153.34 43.91 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.379 0.511 . . . . 75.21 112.379 -174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.02 -32.37 67.89 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.565 0.697 . . . . 71.43 110.702 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.24 -27.77 66.08 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.225 -0.898 . . . . 62.11 112.002 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.55 -42.15 1.52 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 121.383 -0.437 . . . . 73.44 112.737 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -75.85 151.62 37.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.063 0.459 . . . . 74.14 111.702 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.55 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 36.9 t -88.13 136.86 22.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.411 -0.359 . . . . 73.04 111.414 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t -84.83 149.89 25.4 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.765 0.317 . . . . 72.2 110.539 174.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.05 -14.79 61.48 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.131 0.419 . . . . 74.51 112.131 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.28 142.2 58.5 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.936 0.398 . . . . 64.14 111.333 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.499 HG12 ' HG2' ' A' ' 29' ' ' ARG . 43.9 mt -100.58 139.07 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.501 -0.318 . . . . 75.11 110.696 -178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.61 -58.29 2.23 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.776 0.322 . . . . 74.13 111.121 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.42 159.38 42.29 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.135 0.493 . . . . 73.11 111.505 177.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.2 mtt-85 -115.62 116.89 28.89 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.264 -0.425 . . . . 62.52 110.67 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 m -92.49 129.09 38.52 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.655 0.243 . . . . 60.21 111.655 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.459 ' OH ' HD11 ' A' ' 67' ' ' LEU . 49.6 m-85 -116.77 156.52 27.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.679 0.392 . . . . 72.42 111.442 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -100.18 112.78 25.1 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.166 -0.47 . . . . 75.33 111.061 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.2 mt -114.93 149.01 37.93 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 122.292 -0.255 . . . . 74.54 110.788 177.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.691 ' HZ3' ' HB2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -103.83 141.55 35.93 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 122.043 -0.411 . . . . 73.42 111.469 173.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.9 p -93.46 115.96 28.49 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.073 -0.512 . . . . 72.23 110.743 176.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.415 ' HB3' ' H ' ' A' ' 18' ' ' GLU . 1.2 tmtp? -57.92 -40.66 80.94 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.921 0.391 . . . . 74.42 111.507 178.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.36 -58.53 9.28 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.268 -0.492 . . . . 62.32 113.969 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.425 HE22 ' HA ' ' A' ' 16' ' ' PHE . 2.1 mp0 -85.77 -31.45 22.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.325 0.491 . . . . 74.21 112.325 -176.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 92.79 24.95 21.84 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 120.877 -0.678 . . . . 65.41 114.525 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -139.88 167.22 22.61 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 117.601 0.701 . . . . 73.44 112.282 177.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.566 ' N ' ' SD ' ' A' ' 56' ' ' MET . 1.2 mpt? -79.13 157.94 27.84 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.319 0.859 . . . . 73.33 113.319 -173.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.1 pt -142.03 135.02 28.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.01 -0.995 . . . . 73.04 109.586 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.443 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 24.0 mp0 -93.15 104.35 16.55 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.159 0.504 . . . . 72.54 111.574 -178.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 84.7 t -96.94 130.02 46.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 116.378 -0.373 . . . . 74.34 111.419 -177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m -119.15 129.26 54.92 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.682 0.277 . . . . 71.11 111.434 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.404 HG12 ' HE1' ' A' ' 46' ' ' TYR . 25.9 pt -123.23 149.6 57.99 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.584 -0.28 . . . . 74.35 110.575 176.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.73 139.62 39.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.557 2.171 . . . . 73.11 113.226 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.2 -26.32 67.64 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 112.585 0.587 . . . . 73.02 112.585 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.4 t -63.8 -30.28 71.39 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.03 0.443 . . . . 73.3 111.3 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.0 t -72.18 130.41 86.38 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.216 -0.447 . . . . 72.24 110.708 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -43.66 131.88 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 123.175 2.584 . . . . 75.44 114.323 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.459 HD11 ' OH ' ' A' ' 46' ' ' TYR . 62.0 tp -58.37 137.68 57.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.996 -0.547 . . . . 72.31 111.201 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.471 ' HA ' ' HE3' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -75.05 125.95 30.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.198 0.523 . . . . 73.33 111.255 177.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -118.01 22.43 12.24 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.849 -0.614 . . . . 65.33 111.384 -175.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.412 ' CE2' ' HG3' ' A' ' 68' ' ' LYS . 26.0 m-85 -69.34 172.29 7.31 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.522 0.564 . . . . 73.33 112.522 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.43 174.93 8.66 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.879 -0.6 . . . . 73.5 111.576 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -74.21 135.66 42.76 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 110.012 -0.366 . . . . 74.2 110.012 176.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.523 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 95.0 m-20 60.56 20.97 10.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.799 0.44 . . . . 74.55 112.105 -174.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.421 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . -68.13 139.9 56.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.926 0.393 . . . . 72.02 111.663 178.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.581 ' HG3' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -68.1 111.13 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.073 -0.512 . . . . 74.21 111.145 179.342 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.9 m -129.41 147.92 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.362 0.601 . . . . 74.25 112.133 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -133.16 151.2 51.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.025 -0.534 . . . . 72.3 110.727 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.408 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -99.95 135.48 41.32 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.301 -0.409 . . . . 74.23 111.768 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.8 mp -67.77 -76.01 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.386 -0.37 . . . . 74.42 111.061 177.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -126.7 85.36 60.8 Favored Pre-proline 0 N--CA 1.472 0.648 0 CA-C-O 120.754 0.312 . . . . 73.45 110.951 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.27 156.19 14.63 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 123.219 2.613 . . . . 73.31 114.469 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.4 pt -142.81 123.11 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.82 -0.627 . . . . 75.54 110.32 171.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.0 126.88 30.87 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.354 -0.216 . . . . 64.15 110.929 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -65.64 147.54 53.23 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.193 0.52 . . . . 71.31 111.271 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.2 m -64.26 -55.89 18.33 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.978 -0.555 . . . . 72.42 112.287 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.7 m -146.53 91.38 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 120.941 0.401 . . . . 74.21 111.646 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.15 -23.72 65.75 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.269 0.47 . . . . 74.3 112.269 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.4 t -81.03 -9.07 59.89 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.009 0.433 . . . . 74.54 112.037 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -121.12 -45.0 2.37 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.202 0.445 . . . . 74.02 112.202 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.7 p -57.57 -54.08 50.9 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.236 0.541 . . . . 73.41 110.5 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -88.05 96.33 10.47 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.974 -0.751 . . . . 74.0 108.974 167.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -61.82 91.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.488 0.661 . . . . 75.41 112.495 -171.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -175.74 138.06 4.02 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.38 -0.827 . . . . 75.43 111.512 177.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.21 87.33 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.294 0.547 . . . . 75.44 112.424 -176.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -132.15 173.4 11.27 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.415 -0.357 . . . . 72.43 110.158 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 8.3 p -135.66 0.17 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 N-CA-C 112.983 0.735 . . . . 72.31 112.983 -174.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.98 -171.05 2.72 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.641 -0.662 . . . . 63.34 110.151 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 -146.23 144.72 30.07 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.984 0.897 . . . . 71.12 113.309 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.443 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 37.6 m-85 -106.57 149.49 27.11 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.861 -1.063 . . . . 74.11 111.683 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.3 mt -130.37 108.02 15.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 116.227 -0.442 . . . . 74.13 110.311 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -77.99 129.25 35.06 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 122.295 -0.253 . . . . 73.31 111.139 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -130.65 151.71 50.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.29 0.478 . . . . 73.0 112.29 -176.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.1 -39.88 93.98 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.18 -0.464 . . . . 63.14 111.436 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -172.39 162.3 5.38 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.207 -0.451 . . . . 73.22 111.092 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.408 HG12 ' CD2' ' A' ' 78' ' ' LEU . 31.2 mt -122.42 117.43 52.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 115.938 -0.573 . . . . 72.53 110.839 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.9 m -122.34 -179.33 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.21 0.204 . . . . 74.2 111.232 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 88.4 mt -77.85 147.55 35.09 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 120.952 0.406 . . . . 74.3 111.943 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.8 m -72.55 143.12 48.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.358 0.503 . . . . 74.41 112.358 -177.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.45 46.24 1.36 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.792 0.664 . . . . 73.34 112.792 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.253 1.27 0 CA-C-O 118.746 -0.645 . . . . 75.3 111.58 177.638 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 111.71 0.263 . . . . 72.42 111.71 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.417 ' C ' ' H ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -54.25 88.01 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.308 0.484 . . . . 62.41 112.308 -173.265 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.3 ptt180 54.11 -3.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.558 1.318 . . . . 74.54 114.558 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' A' ' 2' ' ' MET . 80.3 mt -64.38 -53.18 52.55 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.795 -0.566 . . . . 73.22 111.365 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.611 ' HB1' ' O ' ' A' ' 8' ' ' ILE . . . -115.6 -65.28 1.21 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.972 -0.558 . . . . 74.04 111.145 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 59.4 t30 64.13 -78.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.924 0.713 . . . . 75.34 112.924 174.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 -47.21 27.58 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 121.262 -0.494 . . . . 73.53 113.382 -176.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.611 ' O ' ' HB1' ' A' ' 5' ' ' ALA . 34.3 pt -129.61 -170.64 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 122.399 0.279 . . . . 70.23 110.398 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -148.48 131.63 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 120.835 0.35 . . . . 74.44 110.91 175.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.441 HD22 ' N ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -125.67 -9.34 6.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.823 0.344 . . . . 75.51 111.713 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.09 -19.41 34.33 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 120.75 0.309 . . . . 73.44 111.816 175.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -125.95 125.22 42.37 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.919 0.34 . . . . 71.35 111.919 -176.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -72.93 104.4 4.06 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.913 0.387 . . . . 53.11 111.531 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.0 t -77.35 145.1 37.53 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.765 0.317 . . . . 72.14 111.204 176.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.2 p -114.67 136.74 52.72 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.997 0.427 . . . . 64.33 111.931 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -87.63 154.44 20.6 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.22 -0.445 . . . . 72.11 111.622 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -86.78 169.88 41.23 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.731 -0.747 . . . . 62.3 112.533 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.53 109.19 0.46 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.546 0.688 . . . . 73.44 111.495 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt -74.68 147.69 41.24 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.855 -0.612 . . . . 75.31 112.263 -173.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.551 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 47.4 mmtm -123.97 121.86 36.4 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 55.31 111.456 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -66.75 102.04 0.89 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.818 0.342 . . . . 74.2 110.581 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 21.9 t -89.61 -63.59 1.26 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 111.972 0.36 . . . . 74.34 111.972 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.29 -178.52 7.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.288 0.477 . . . . 62.11 112.288 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.6 tp -89.35 118.03 28.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.941 0.4 . . . . 71.44 110.896 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.8 -64.48 1.03 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.958 0.409 . . . . 75.41 111.748 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -164.71 136.85 4.52 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.36 -0.382 . . . . 75.22 111.335 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -97.9 101.46 12.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.803 0.335 . . . . 74.43 110.243 173.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 42' ' ' LYS . 18.3 m -72.2 98.75 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 121.657 0.741 . . . . 73.31 111.327 -178.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' HG12 ' A' ' 41' ' ' ILE . 85.6 mtt-85 -89.64 155.66 19.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.881 -0.6 . . . . 74.33 111.611 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.587 HG12 ' HE3' ' A' ' 42' ' ' LYS . 56.7 mt -68.85 106.66 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.995 -0.548 . . . . 71.34 111.258 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -85.61 123.93 31.58 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.839 0.352 . . . . 73.11 110.925 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -66.35 157.19 32.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.31 -0.405 . . . . 74.22 111.714 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -62.46 -25.84 68.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.077 0.465 . . . . 75.4 110.99 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -63.87 -15.84 59.92 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 116.021 -0.536 . . . . 74.4 111.611 175.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 -18.46 40.91 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.399 -0.364 . . . . 70.03 112.866 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.4 p -77.8 157.49 29.93 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.14 0.495 . . . . 70.43 111.876 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.0 t -102.4 134.85 42.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.459 -0.337 . . . . 73.54 111.28 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.4 t -90.77 155.3 18.89 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.833 0.349 . . . . 62.12 111.701 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.36 -30.51 69.6 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.161 0.505 . . . . 75.24 110.686 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.23 138.91 57.42 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.49 -0.777 . . . . 72.2 111.799 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.613 HG12 ' HG2' ' A' ' 29' ' ' ARG . 53.1 mt -115.9 138.17 47.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.943 0.401 . . . . 73.41 111.983 -175.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.587 ' HE3' HG12 ' A' ' 30' ' ' ILE . 32.8 mmtp -72.67 -57.18 4.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.444 0.64 . . . . 73.44 110.205 171.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.488 ' HB3' ' HA ' ' A' ' 62' ' ' PRO . 8.9 pt-20 -163.92 166.15 21.99 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.489 -0.778 . . . . 63.2 111.563 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.502 HH12 ' HB2' ' A' ' 67' ' ' LEU . 31.2 mtp180 -114.3 118.34 33.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.464 -0.334 . . . . 74.44 111.5 -172.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 21.8 m -92.87 131.04 38.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 111.827 0.306 . . . . 74.52 111.827 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.418 ' HH ' HD12 ' A' ' 61' ' ' ILE . 68.4 m-85 -120.48 143.78 48.35 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.01 0.433 . . . . 71.45 111.88 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -75.12 109.31 8.5 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.927 -0.579 . . . . 64.22 110.496 173.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.452 HD12 HG22 ' A' ' 59' ' ' VAL . 41.0 mt -111.93 131.99 55.03 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.354 0.597 . . . . 75.1 111.808 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.47 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.6 mmtm -96.07 136.42 36.54 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.947 -0.569 . . . . 62.54 110.41 176.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.5 t -126.41 105.14 8.56 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 122.055 -0.403 . . . . 72.33 111.425 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -65.19 -40.06 93.69 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.865 0.364 . . . . 74.35 111.807 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.64 -23.06 48.55 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 121.219 -0.515 . . . . 71.4 114.205 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -112.54 -23.07 10.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 117.426 0.613 . . . . 64.52 111.934 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 87.94 -5.09 85.36 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.352 0.501 . . . . 72.25 114.352 175.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -118.44 172.55 7.39 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.572 0.701 . . . . 75.4 112.808 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 70.5 mtp -93.14 137.43 32.49 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.245 -0.889 . . . . 73.32 110.725 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 40.0 pt -121.64 138.71 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 120.956 0.407 . . . . 74.44 111.114 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.7 106.41 18.72 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.519 -0.309 . . . . 73.11 111.395 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 95.7 t -105.24 128.76 58.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.441 0.534 . . . . 74.24 112.441 -176.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -113.67 132.5 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.177 -0.465 . . . . 64.4 111.645 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.418 HD12 ' HH ' ' A' ' 46' ' ' TYR . 34.0 pt -110.92 136.38 20.77 Favored Pre-proline 0 N--CA 1.474 0.764 0 CA-C-O 120.522 0.201 . . . . 75.03 111.073 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.488 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 33.3 Cg_endo -62.28 158.44 40.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.752 2.301 . . . . 74.31 113.33 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.99 -16.65 5.15 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.823 0.675 . . . . 73.12 112.823 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -68.86 -10.23 55.84 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.159 0.429 . . . . 45.21 112.159 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -108.82 129.75 23.57 Favored Pre-proline 0 CA--C 1.544 0.716 0 N-CA-C 112.261 0.467 . . . . 72.42 112.261 -176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -64.74 161.68 34.9 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.742 2.295 . . . . 72.41 113.072 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.502 ' HB2' HH12 ' A' ' 44' ' ' ARG . 62.7 tp -67.93 134.58 51.03 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.056 0.455 . . . . 74.35 112.103 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.474 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.91 108.64 17.02 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.291 -0.413 . . . . 75.33 111.027 174.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.75 78.67 9.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.049 0.452 . . . . 72.35 110.897 176.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -112.86 150.81 31.21 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.96 0.409 . . . . 74.22 111.2 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -77.34 171.16 15.31 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.327 0.584 . . . . 70.12 111.734 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -59.39 124.37 19.8 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.178 0.513 . . . . 73.33 111.917 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.415 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 94.4 m-20 63.36 35.42 12.28 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.731 -0.668 . . . . 65.43 112.135 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.86 137.36 57.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.367 . . . . 74.21 111.803 177.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.551 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 58.3 mtp180 -67.83 97.06 0.62 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.251 -0.431 . . . . 74.43 112.057 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 107' ' ' LEU . 33.9 m -122.04 176.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 121.325 0.583 . . . . 71.04 112.527 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -159.38 179.58 8.83 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.784 -0.644 . . . . 74.52 110.448 175.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.456 HD13 HG22 ' A' ' 59' ' ' VAL . 85.5 mt -115.45 149.44 38.03 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.579 0.585 . . . . 73.32 112.579 -173.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.558 HG21 ' ND2' ' A' ' 80' ' ' ASN . 48.7 mm -83.21 -73.16 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.893 -0.594 . . . . 73.41 111.094 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.558 ' ND2' HG21 ' A' ' 79' ' ' ILE . 51.1 m-80 -121.35 87.11 44.44 Favored Pre-proline 0 N--CA 1.477 0.885 0 O-C-N 122.244 -0.285 . . . . 72.35 111.527 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.01 136.04 9.0 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 122.928 2.419 . . . . 74.35 113.577 175.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 101' ' ' LYS . 35.8 pt -128.65 134.72 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 121.037 0.446 . . . . 71.44 111.399 172.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.56 111.93 15.11 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.45 -0.341 . . . . 61.11 110.11 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.452 ' OD1' HG13 ' A' ' 86' ' ' VAL . 6.2 t0 -102.8 153.78 19.84 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.123 0.487 . . . . 74.35 111.882 -172.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.1 p -115.3 5.27 14.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.117 -0.492 . . . . 74.25 112.246 -178.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.452 HG13 ' OD1' ' A' ' 84' ' ' ASP . 6.5 m -46.61 -31.78 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.483 0.92 . . . . 75.33 113.483 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.64 0.39 15.21 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.051 0.76 . . . . 53.31 113.051 -176.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -73.59 -5.75 42.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.627 0.602 . . . . 64.35 112.627 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -94.6 -56.95 2.62 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.438 0.532 . . . . 73.14 112.438 -177.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.8 t -78.63 -25.31 45.03 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.539 0.57 . . . . 74.21 112.539 -176.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -104.91 132.47 51.1 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.01 0.433 . . . . 65.34 111.657 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -79.01 44.85 0.58 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.186 -0.461 . . . . 72.43 111.139 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.68 105.14 2.73 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 121.511 -0.376 . . . . 73.42 112.407 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -114.0 43.46 1.84 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.169 0.509 . . . . 64.1 111.523 -176.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -83.85 10.88 8.57 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.568 0.581 . . . . 64.33 112.568 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.403 HG12 ' OD1' ' A' ' 97' ' ' ASP . 2.8 p -68.63 -55.66 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 N-CA-C 111.774 0.287 . . . . 74.33 111.774 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.403 ' OD1' HG12 ' A' ' 96' ' ' VAL . 19.0 p-10 -148.58 106.26 3.68 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.625 0.726 . . . . 72.24 110.887 174.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -57.91 148.43 25.69 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.192 1.182 . . . . 75.32 114.192 -172.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -103.51 116.62 32.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.231 -0.895 . . . . 75.11 111.902 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 35.7 mt -105.73 104.42 16.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.353 -0.84 . . . . 72.41 110.692 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.505 ' O ' HG12 ' A' ' 82' ' ' ILE . 4.7 mtpm? -86.6 121.83 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 122.106 -0.371 . . . . 73.12 110.204 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.46 161.46 19.55 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.321 0.86 . . . . 71.33 113.321 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 21.5 t70 -63.91 -55.18 24.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.327 -0.851 . . . . 72.55 111.652 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -158.09 159.11 35.92 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.963 0.411 . . . . 74.3 111.364 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.474 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 57.0 mt -116.71 121.7 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.081 -0.509 . . . . 75.53 111.15 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 30.8 m -124.36 -179.13 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.401 -0.363 . . . . 74.44 110.832 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 76' ' ' VAL . 93.9 mt -80.86 151.22 28.77 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.091 -0.381 . . . . 70.51 111.327 177.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 26.1 m -63.86 125.45 24.43 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.259 0.466 . . . . 73.41 112.259 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -80.44 108.08 13.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.996 -0.547 . . . . 74.21 111.372 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 . . . . . 0 C--O 1.256 1.398 0 N-CA-C 111.981 0.363 . . . . 64.31 111.981 179.753 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 120.823 0.344 . . . . 73.43 111.538 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -158.58 162.15 37.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.435 -0.348 . . . . 71.54 110.91 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -89.45 -3.37 58.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.099 0.407 . . . . 74.34 112.099 -179.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.434 ' N ' HD21 ' A' ' 4' ' ' LEU . 3.3 mm? -74.82 141.39 44.3 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.715 0.293 . . . . 71.03 111.305 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 65.3 11.52 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.638 0.607 . . . . 61.22 112.638 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.98 -43.06 65.73 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.887 0.375 . . . . 74.14 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -174.43 94.75 0.1 OUTLIER Glycine 0 CA--C 1.526 0.771 0 C-N-CA 121.295 -0.478 . . . . 73.44 112.743 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.6 pt -134.69 170.01 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.937 0.398 . . . . 62.52 111.599 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -80.77 105.54 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.963 0.411 . . . . 74.41 111.002 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -51.59 -44.82 62.94 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.308 0.855 . . . . 72.22 113.308 -178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -162.57 170.08 19.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.075 0.464 . . . . 73.54 111.806 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -157.57 101.69 1.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.99 -0.55 . . . . 75.22 111.982 173.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 72.62 -53.48 0.7 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.868 0.867 . . . . 73.45 113.241 176.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.1 p -56.45 106.28 0.27 Allowed 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.152 0.427 . . . . 71.41 112.152 -178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -85.88 99.35 11.34 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.453 0.644 . . . . 73.45 111.749 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.42 ' HZ ' ' HH2' ' A' ' 98' ' ' TRP . 55.4 m-85 -84.29 117.24 23.44 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.229 -0.441 . . . . 73.14 111.473 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.642 ' HA3' ' HA3' ' A' ' 52' ' ' GLY . . . -71.34 175.69 39.36 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.104 -0.569 . . . . 44.11 112.73 176.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -53.33 112.37 0.87 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 121.451 0.643 . . . . 74.23 112.261 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 69.8 mt -85.32 133.87 34.13 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.599 -0.728 . . . . 73.22 110.743 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 90.2 mttt -126.66 127.37 45.07 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.094 0.474 . . . . 73.45 112.157 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -67.35 136.06 54.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.88 -0.6 . . . . 74.31 111.532 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.2 p -113.51 -63.51 1.44 Allowed 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.989 -0.445 . . . . 73.0 111.229 174.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.78 -173.95 4.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.077 0.465 . . . . 52.43 111.759 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 60.4 tp -92.7 124.43 36.71 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.469 -0.332 . . . . 75.14 110.764 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 25' ' ' ARG . 4.1 tpp180 -75.84 -58.1 3.48 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.864 0.364 . . . . 74.11 111.942 -177.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -168.55 141.14 2.88 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.024 0.44 . . . . 72.34 111.817 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -101.2 98.36 8.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.714 -0.476 . . . . 75.31 109.714 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 m -70.15 110.8 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.356 0.598 . . . . 74.52 110.209 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.499 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 81.7 mtt180 -100.34 156.32 17.31 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.513 0.56 . . . . 73.41 112.513 -171.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.73 115.43 2.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.733 -0.667 . . . . 71.44 111.844 -174.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -88.67 119.17 28.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.278 -0.419 . . . . 73.45 110.92 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -60.59 159.91 9.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.062 0.458 . . . . 73.14 111.619 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.76 -18.03 52.37 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.098 -0.501 . . . . 71.45 111.905 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -83.36 -0.11 48.35 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.185 0.439 . . . . 70.51 112.185 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -11.22 70.72 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.169 -0.539 . . . . 75.45 113.726 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -86.98 152.19 22.61 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.418 -0.46 . . . . 60.1 111.606 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.4 t -95.04 125.62 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 120.952 0.406 . . . . 70.1 111.455 -178.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -79.73 176.39 9.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.355 0.598 . . . . 54.33 111.973 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -83.68 -23.41 31.73 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.029 -0.532 . . . . 74.31 111.208 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.61 143.7 54.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.895 0.379 . . . . 74.52 111.11 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.499 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.1 mt -101.14 141.56 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 121.045 0.45 . . . . 74.44 112.16 -174.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -82.53 -50.86 8.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.396 0.617 . . . . 74.24 109.903 174.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -165.98 159.94 16.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.426 -0.806 . . . . 53.33 110.982 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.8 mtt180 -107.58 123.59 48.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.073 0.397 . . . . 72.23 112.073 -175.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.5 m -96.24 114.07 25.72 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.739 0.304 . . . . 74.13 111.382 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -101.04 156.16 17.57 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.959 0.409 . . . . 71.5 111.762 178.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.553 ' HB3' ' HZ3' ' A' ' 49' ' ' LYS . 26.8 m-20 -97.65 116.78 30.52 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.033 -0.53 . . . . 72.55 111.827 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.464 HD12 HG21 ' A' ' 59' ' ' VAL . 66.9 mt -118.86 126.77 52.56 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.05 0.453 . . . . 73.13 111.003 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.553 ' HZ3' ' HB3' ' A' ' 47' ' ' ASP . 0.5 OUTLIER -104.74 115.49 30.41 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.978 0.418 . . . . 72.03 111.272 178.603 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -80.01 105.32 11.2 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.902 0.382 . . . . 65.14 110.805 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -79.14 -21.33 46.69 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.793 0.33 . . . . 75.43 111.591 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.642 ' HA3' ' HA3' ' A' ' 17' ' ' GLY . . . -68.19 -47.03 61.27 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.038 -0.601 . . . . 74.55 112.984 176.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -96.75 -32.43 12.15 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 122.494 -0.416 . . . . 64.34 111.664 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 91.54 39.62 5.56 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.276 -0.488 . . . . 43.23 113.921 177.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -136.62 160.46 38.74 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.293 0.568 . . . . 75.43 112.319 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.521 ' HG3' ' HD2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -94.98 133.3 38.89 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.69 -0.686 . . . . 64.12 111.616 178.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.7 pt -126.3 141.53 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 120.636 0.255 . . . . 75.24 111.084 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -105.19 111.36 24.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.032 0.444 . . . . 75.14 110.844 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 92.7 t -101.98 137.59 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.385 -0.37 . . . . 62.43 111.446 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 89.0 p -124.65 128.81 49.43 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.292 0.568 . . . . 65.24 112.048 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.472 HG23 HG13 ' A' ' 105' ' ' ILE . 29.0 pt -118.91 153.92 52.84 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 115.829 -0.623 . . . . 72.11 110.69 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.43 153.28 55.29 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.406 2.071 . . . . 73.12 113.399 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -16.92 60.17 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.152 0.427 . . . . 72.1 112.152 -178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 74.5 p -66.27 -18.8 65.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.841 0.353 . . . . 75.33 111.601 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.37 124.32 53.8 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 116.562 -0.29 . . . . 74.2 111.303 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.37 169.29 18.76 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.0 2.467 . . . . 61.11 114.141 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.0 tp -70.85 128.82 37.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.908 -0.587 . . . . 73.32 111.513 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 105' ' ' ILE . 0.2 OUTLIER -86.41 114.72 23.41 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.262 0.553 . . . . 73.43 112.294 178.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.96 51.91 1.42 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.716 -0.674 . . . . 64.52 111.205 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -76.71 159.03 30.53 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.325 0.584 . . . . 75.11 112.108 -177.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -77.03 148.26 36.29 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.886 -0.597 . . . . 63.0 111.334 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -59.85 119.27 7.38 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.87 0.367 . . . . 74.41 111.521 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.468 ' N ' HD21 ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.99 24.83 3.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.319 0.648 . . . . 72.31 112.387 179.119 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.97 137.3 43.44 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.549 -0.296 . . . . 52.31 110.577 171.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 19' ' ' LEU . 76.2 mtm-85 -66.85 126.62 29.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.75 0.31 . . . . 74.12 111.44 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.528 HG13 HD22 ' A' ' 107' ' ' LEU . 27.1 m -129.13 151.53 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 121.285 0.564 . . . . 72.34 112.328 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.67 157.86 43.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.182 -0.463 . . . . 73.04 110.445 174.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.8 mt -106.02 141.87 36.68 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.093 0.775 . . . . 74.23 113.093 -170.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.517 HG21 ' ND2' ' A' ' 80' ' ' ASN . 38.8 mm -97.22 118.17 43.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.619 -0.718 . . . . 73.34 110.115 174.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.517 ' ND2' HG21 ' A' ' 79' ' ' ILE . 45.4 m-80 61.55 58.33 3.15 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 123.154 0.581 . . . . 71.12 111.962 -173.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -81.82 132.52 7.6 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.753 2.302 . . . . 73.31 113.745 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.1 pt -139.36 142.22 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-O 120.764 0.316 . . . . 74.53 111.241 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.03 123.16 24.67 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.246 -0.284 . . . . 65.22 110.697 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -73.75 145.5 45.05 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.09 0.471 . . . . 62.22 111.057 -175.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 80.2 p -105.98 5.12 30.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.25 -0.432 . . . . 53.42 111.9 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.99 151.27 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.721 0.296 . . . . 73.43 111.123 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.46 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . . . 71.5 -7.36 1.22 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.661 0.986 . . . . 74.34 113.661 173.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.5 p -56.27 -37.61 70.04 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.43 0.53 . . . . 75.4 112.43 -177.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.26 -11.68 34.63 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.013 0.375 . . . . 75.41 112.013 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.8 m -82.33 -38.22 24.59 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.938 0.399 . . . . 74.11 111.633 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.46 ' CE1' ' HB2' ' A' ' 87' ' ' ALA . 3.7 m-85 -75.75 -178.84 4.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.638 0.607 . . . . 70.53 112.638 -176.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.638 ' HB2' ' HB3' ' A' ' 95' ' ' ASP . 63.5 mm-40 -97.51 -179.44 4.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.63 0.604 . . . . 63.44 112.63 -169.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.73 -48.81 79.18 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-N 115.941 -0.572 . . . . 54.31 114.226 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.96 -1.79 13.72 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 122.349 -0.5 . . . . 74.05 111.921 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' A' ' 92' ' ' GLN . 27.0 t70 -101.69 102.6 13.29 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.872 0.323 . . . . 70.2 111.872 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.2 p -178.79 114.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 112.623 0.601 . . . . 75.42 112.623 173.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -97.0 107.85 20.46 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.191 -0.67 . . . . 64.45 109.191 167.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.42 ' HH2' ' HZ ' ' A' ' 16' ' ' PHE . 1.5 p-90 -62.32 160.18 13.73 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.464 1.283 . . . . 62.42 114.464 -167.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -114.86 144.94 42.74 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.258 -1.337 . . . . 75.21 111.423 -174.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 61.0 mt -129.65 122.1 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.332 -0.395 . . . . 74.52 110.97 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -89.27 149.14 23.2 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 122.081 -0.387 . . . . 75.03 110.702 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.61 161.18 42.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 74.42 111.496 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.87 -30.93 24.05 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.945 0.402 . . . . 71.44 110.986 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.402 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 25.3 t0 -161.19 153.94 20.76 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.399 0.619 . . . . 65.35 112.045 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.472 HG13 HG23 ' A' ' 61' ' ' ILE . 62.0 mt -115.11 114.18 45.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.515 -0.766 . . . . 72.54 111.178 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.2 m -123.89 178.54 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.834 0.349 . . . . 74.3 111.599 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.528 HD22 HG13 ' A' ' 76' ' ' VAL . 98.0 mt -85.12 146.33 27.19 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.785 0.326 . . . . 74.31 111.68 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.1 m -65.13 149.42 49.93 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.805 0.336 . . . . 74.33 111.152 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.0 mt -75.95 38.8 0.17 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.816 0.673 . . . . 72.3 112.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 118.993 -0.527 . . . . 72.05 111.079 174.754 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 ptp . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.897 0.379 . . . . 71.35 111.449 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.4 mmt -104.19 157.03 17.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.301 0.572 . . . . 74.2 111.674 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -95.26 96.82 9.43 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.205 -0.452 . . . . 74.11 111.07 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -82.23 130.92 35.21 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.51 -0.314 . . . . 65.11 111.103 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.65 165.51 24.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.536 -0.302 . . . . 64.41 111.38 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -58.24 -59.28 5.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.106 0.409 . . . . 70.13 112.106 -177.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 66.51 24.8 72.55 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.956 -0.64 . . . . 73.13 112.819 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 11' ' ' ASP . 19.8 pt -99.18 159.5 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.132 0.492 . . . . 63.03 111.956 -176.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.2 t -119.24 -62.36 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 121.186 0.517 . . . . 75.52 110.948 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.7 mt -98.08 -54.76 2.98 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.175 0.512 . . . . 71.34 110.819 179.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.436 ' O ' HD13 ' A' ' 8' ' ' ILE . 3.7 m-20 -54.72 92.26 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.193 -0.912 . . . . 74.24 112.243 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -129.8 -176.56 3.96 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.153 0.501 . . . . 74.13 111.308 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -88.02 124.49 33.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.951 0.405 . . . . 72.04 110.049 172.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.407 ' HB ' ' CE2' ' A' ' 16' ' ' PHE . 23.4 p -64.73 -19.7 65.93 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.468 0.544 . . . . 72.3 112.468 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 47.8 m 61.89 81.51 0.19 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.426 0.632 . . . . 72.24 112.343 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.407 ' CE2' ' HB ' ' A' ' 14' ' ' THR . 63.9 m-85 -132.83 136.19 46.1 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.949 -0.569 . . . . 64.12 110.888 174.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -97.52 -92.63 1.91 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 120.924 -0.655 . . . . 51.05 112.261 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -90.27 108.84 20.01 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.923 0.392 . . . . 74.41 111.624 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.6 mt -107.78 129.72 55.03 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 110.156 -0.313 . . . . 73.4 110.156 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.581 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -118.62 139.94 50.71 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.351 0.5 . . . . 73.25 112.351 -177.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -77.13 142.6 39.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.926 -0.579 . . . . 74.34 111.282 176.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 46.3 t -123.72 -62.69 1.28 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.253 -0.431 . . . . 72.3 111.454 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.63 174.54 15.19 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.127 0.489 . . . . 70.33 111.858 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.8 tp -87.85 113.43 23.5 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.012 -0.54 . . . . 73.53 110.984 177.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 25' ' ' ARG . 11.6 tpp85 -61.44 -58.13 9.44 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.744 0.307 . . . . 71.42 111.443 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -176.71 143.08 0.44 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.413 0.523 . . . . 74.43 112.413 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -101.21 98.27 8.69 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.29 -0.633 . . . . 73.44 109.29 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.522 HG23 ' HB3' ' A' ' 42' ' ' LYS . 30.0 m -77.46 126.6 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 120.898 0.38 . . . . 71.33 111.756 -175.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.562 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.5 mtt180 -96.03 158.26 15.52 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.89 0.376 . . . . 73.15 111.525 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mt -72.3 139.93 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 116.115 -0.493 . . . . 74.23 111.006 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -107.16 122.71 47.04 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.982 -0.449 . . . . 75.32 111.359 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -72.17 167.4 20.39 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.299 0.571 . . . . 72.41 112.22 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.92 -24.75 64.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.969 -0.559 . . . . 74.34 111.592 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -65.15 -14.06 59.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.002 0.429 . . . . 63.51 111.932 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.55 -3.24 83.49 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.13 -0.557 . . . . 74.45 112.535 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -98.3 148.73 23.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.212 0.53 . . . . 74.4 111.764 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.98 141.93 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.889 -0.596 . . . . 72.14 111.599 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -90.51 169.61 10.89 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.073 -0.512 . . . . 74.42 112.205 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -76.73 -26.96 55.22 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.812 -0.631 . . . . 73.14 110.895 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -77.42 146.21 36.7 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.614 0.721 . . . . 73.2 111.93 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.0 mt -99.46 144.83 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.591 -0.731 . . . . 74.43 111.068 -176.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HB3' HG23 ' A' ' 28' ' ' VAL . 27.7 tptp -82.91 -57.62 3.22 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.304 -0.407 . . . . 70.54 111.076 177.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -168.38 160.93 11.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.916 0.388 . . . . 73.33 111.494 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -107.84 125.96 52.08 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.879 0.371 . . . . 75.33 111.912 -175.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -107.45 121.19 44.12 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.183 -0.462 . . . . 70.13 112.145 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.658 ' HH ' HD12 ' A' ' 67' ' ' LEU . 91.9 m-85 -108.64 152.68 24.47 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.688 0.395 . . . . 75.32 111.989 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.64 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 11.9 m-20 -97.63 111.66 23.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.709 0.633 . . . . 73.44 112.709 177.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.1 mt -114.65 128.49 56.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.982 -0.553 . . . . 72.43 110.344 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.64 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 2.4 mptp? -120.29 145.95 46.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.957 0.408 . . . . 75.42 111.592 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -112.41 131.02 55.77 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.859 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -82.38 169.78 16.06 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.901 0.381 . . . . 74.41 111.807 -177.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.29 -74.86 1.01 Allowed Glycine 0 CA--C 1.524 0.602 0 C-N-CA 121.275 -0.488 . . . . 71.5 112.724 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.467 ' HG3' ' HG3' ' A' ' 55' ' ' ARG . 6.9 tp-100 -65.11 -28.84 69.72 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.16 0.505 . . . . 74.2 110.291 174.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.58 52.6 33.51 Favored Glycine 0 CA--C 1.526 0.738 0 CA-C-N 115.874 -0.603 . . . . 74.34 114.317 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.467 ' HG3' ' HG3' ' A' ' 53' ' ' GLN . 49.9 mtt180 -122.53 135.55 54.67 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.264 -0.551 . . . . 72.52 111.194 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.656 ' HE3' ' HB3' ' A' ' 97' ' ' ASP . 18.9 ptt? -111.37 141.25 45.16 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.077 -0.511 . . . . 72.2 111.516 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.498 HD12 HD11 ' A' ' 100' ' ' ILE . 22.4 pt -133.49 137.32 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.164 -0.471 . . . . 72.03 111.565 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.07 114.09 26.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.784 0.326 . . . . 75.42 110.84 175.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 87.7 t -94.97 119.32 42.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.771 0.319 . . . . 62.54 111.573 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.6 m -108.68 114.76 28.83 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.999 0.428 . . . . 53.13 111.894 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 pt -108.09 154.09 41.41 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.117 -0.492 . . . . 74.3 111.079 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.57 146.78 51.74 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.747 2.298 . . . . 74.41 113.486 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.25 64.72 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.128 0.788 . . . . 73.32 113.128 -175.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 t -68.99 -19.21 64.14 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.998 0.428 . . . . 73.12 111.386 177.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.3 t -87.1 127.08 60.68 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.406 -0.361 . . . . 74.14 110.864 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.5 177.94 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.722 2.281 . . . . 74.53 113.886 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.658 HD12 ' HH ' ' A' ' 46' ' ' TYR . 54.0 tp -79.92 126.51 31.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.794 -0.639 . . . . 74.23 111.894 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -80.61 122.85 27.58 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.2 0.524 . . . . 75.42 111.74 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.31 76.88 1.74 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.129 0.49 . . . . 73.23 111.075 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -90.04 -172.51 3.53 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.134 0.492 . . . . 74.4 112.126 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -118.11 161.6 19.57 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 116.275 -0.42 . . . . 72.44 111.384 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.34 124.39 20.78 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.873 0.368 . . . . 70.33 111.276 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.581 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 41.9 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 112.74 0.645 . . . . 75.2 112.74 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.66 124.91 25.39 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.302 -0.249 . . . . 74.1 110.88 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -63.21 122.48 16.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.052 0.453 . . . . 73.52 111.527 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.463 HG11 HD21 ' A' ' 107' ' ' LEU . 27.6 m -126.14 140.18 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.12 0.486 . . . . 74.4 111.291 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.411 ' OE2' ' HA ' ' A' ' 108' ' ' THR . 12.7 pt-20 -121.75 152.6 39.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.302 0.572 . . . . 75.44 111.126 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.6 mt -101.19 145.39 28.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.884 -0.598 . . . . 63.42 111.378 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.44 HD11 ' N ' ' A' ' 79' ' ' ILE . 1.9 mp -75.48 -70.98 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.561 -0.29 . . . . 74.02 110.664 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -122.81 86.03 50.01 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-O 120.72 0.295 . . . . 75.01 111.477 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.55 150.14 14.77 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.976 2.45 . . . . 73.33 113.502 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.1 pt -140.97 132.36 28.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 73.11 110.637 171.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.96 125.02 28.83 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 116.575 -0.284 . . . . 64.03 110.96 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -83.19 121.58 27.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.148 0.499 . . . . 73.41 111.105 -177.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.1 p -113.2 -1.04 14.44 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.08 -0.509 . . . . 71.42 111.68 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.4 m -92.48 -13.65 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.121 0.415 . . . . 74.24 112.121 -175.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.09 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.054 0.454 . . . . 65.22 112.07 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.1 p -76.09 46.98 0.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 122.97 0.508 . . . . 72.53 112.202 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.43 104.45 3.92 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.205 -0.31 . . . . 42.43 111.584 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.0 m 72.97 -45.57 0.63 Allowed 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 113.079 0.77 . . . . 71.32 113.079 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -56.11 -47.78 77.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.904 0.705 . . . . 75.34 112.904 -173.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -145.84 130.76 18.18 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.224 -0.298 . . . . 75.42 111.439 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -98.7 -34.02 5.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 121.301 -0.476 . . . . 52.2 113.41 177.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.03 152.2 19.44 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.923 0.392 . . . . 74.41 111.699 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.11 101.45 5.33 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 121.042 0.449 . . . . 71.3 111.924 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.35 -161.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 116.355 -0.384 . . . . 73.32 111.467 -178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.656 ' HB3' ' HE3' ' A' ' 56' ' ' MET . 3.7 p-10 -61.74 117.74 6.22 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.338 0.59 . . . . 72.53 111.301 176.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 8.8 p-90 -98.44 172.26 7.64 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.031 0.752 . . . . 75.23 113.031 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -112.68 140.43 47.45 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.134 0.79 . . . . 65.24 113.134 -172.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 57.2 mt -123.33 113.46 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.209 -0.905 . . . . 75.33 110.39 173.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -84.39 136.22 33.96 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.157 -0.339 . . . . 73.32 110.246 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.94 164.48 30.07 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.263 0.838 . . . . 53.44 113.263 -173.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.54 -66.65 0.63 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.259 -0.882 . . . . 73.51 111.183 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -141.37 162.46 35.43 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.084 0.468 . . . . 74.25 111.572 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 37.4 mt -125.87 121.46 59.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.812 -0.631 . . . . 62.44 110.979 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.1 m -130.99 172.15 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 120.745 0.307 . . . . 73.55 111.55 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.463 HD21 HG11 ' A' ' 76' ' ' VAL . 92.3 mt -76.74 135.82 39.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.602 0.239 . . . . 71.33 111.25 177.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.411 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 6.2 m -67.2 134.69 52.2 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.512 -0.313 . . . . 74.33 111.371 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.33 3.95 9.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 112.214 0.45 . . . . 72.41 112.214 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 . . . . . 0 C--O 1.253 1.26 0 CA-C-O 118.732 -0.651 . . . . 72.44 112.136 -177.51 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 112.323 0.49 . . . . 74.32 112.323 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.6 mmt -111.89 178.66 4.24 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.147 -0.345 . . . . 73.41 111.606 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -93.48 97.89 10.83 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.858 0.361 . . . . 71.0 111.375 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.477 ' HG ' HD12 ' A' ' 8' ' ' ILE . 3.1 mm? -120.59 173.41 7.2 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.971 0.415 . . . . 75.44 111.034 177.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -137.25 -69.4 0.46 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.875 0.369 . . . . 73.41 111.929 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -155.42 175.55 13.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.882 0.372 . . . . 72.44 111.529 -177.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.0 -29.11 4.77 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.307 -0.473 . . . . 42.34 113.374 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.477 HD12 ' HG ' ' A' ' 4' ' ' LEU . 43.8 pt -81.12 -179.75 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.178 0.513 . . . . 73.23 112.099 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.407 ' O ' HG12 ' A' ' 9' ' ' VAL . 5.6 p -73.75 89.76 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.79 0.805 . . . . 74.32 110.974 174.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 11' ' ' ASP . 1.6 pp -77.1 -31.65 56.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.962 -0.563 . . . . 75.32 111.831 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.594 ' N ' HD12 ' A' ' 10' ' ' LEU . 21.7 t0 46.59 63.84 1.75 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.421 0.629 . . . . 64.41 111.512 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -101.14 127.65 47.58 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.8 -0.636 . . . . 75.3 112.006 -172.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.17 94.78 0.53 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.652 0.263 . . . . 73.32 111.207 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.1 t -71.69 -33.21 68.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.944 0.402 . . . . 62.4 111.364 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 m -113.72 124.98 53.58 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.254 -0.43 . . . . 61.3 110.537 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -79.71 140.17 37.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.775 0.322 . . . . 70.24 111.648 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.87 -178.27 17.23 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 120.981 -0.628 . . . . 61.51 112.599 173.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.88 130.85 30.21 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.582 0.706 . . . . 73.43 112.632 -178.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 mt -94.67 148.11 22.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.791 -0.64 . . . . 73.43 110.987 -178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 61.1 mttp -114.31 118.17 33.16 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.093 0.473 . . . . 75.14 112.082 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.39 115.07 13.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.029 -0.532 . . . . 72.33 111.391 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.2 p -99.25 -60.87 1.45 Allowed 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.075 0.398 . . . . 63.1 112.075 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.25 177.88 10.57 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.863 0.69 . . . . 65.54 112.863 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.3 tp -81.98 119.52 24.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.477 -0.783 . . . . 75.2 110.604 173.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 8.5 tpt180 -74.89 -55.76 5.46 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.064 0.394 . . . . 73.5 112.064 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -170.67 143.1 2.11 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.897 0.332 . . . . 74.14 111.897 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -110.49 118.96 37.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.747 0.308 . . . . 75.4 110.588 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.9 m -96.73 117.71 41.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 121.021 0.439 . . . . 70.1 110.619 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.603 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 78.5 mtt180 -91.76 179.52 5.61 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.363 0.601 . . . . 75.22 112.511 -175.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.0 mt -97.83 114.22 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.633 -0.712 . . . . 75.12 110.989 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.539 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.3 tt0 -81.28 130.2 34.93 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.284 0.564 . . . . 73.22 111.527 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.434 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.4 m-20 -80.63 145.78 31.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.792 -0.64 . . . . 74.01 110.682 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -63.36 -18.12 63.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.118 0.485 . . . . 73.33 111.166 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.35 -17.91 63.09 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.937 -0.574 . . . . 73.22 111.703 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.01 -49.15 0.89 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.379 -0.439 . . . . 63.31 113.175 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.5 m -74.45 155.92 37.52 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.067 0.461 . . . . 75.41 111.638 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 40.4 t -96.39 124.33 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.489 -0.323 . . . . 75.42 111.314 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.434 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 47.8 t -59.68 164.46 3.62 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.809 0.67 . . . . 72.24 112.809 -177.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.603 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 10.2 m-20 -81.56 -2.72 51.02 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.963 -0.562 . . . . 74.02 110.659 171.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.85 124.84 27.59 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.057 -0.52 . . . . 74.1 109.949 170.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 48.9 mt -95.46 140.88 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.748 0.309 . . . . 73.53 110.854 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -87.27 -59.55 2.22 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.724 0.297 . . . . 70.21 110.963 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.44 ' CD ' ' HZ1' ' A' ' 101' ' ' LYS . 37.0 mt-10 -137.64 161.05 37.5 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.402 0.62 . . . . 74.42 111.772 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -132.61 111.24 11.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.68 -0.691 . . . . 65.35 110.856 -177.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 31.0 m -95.14 131.65 40.92 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.409 0.522 . . . . 74.23 112.409 -175.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -113.33 152.2 30.22 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.772 0.429 . . . . 72.33 111.444 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.512 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 48.8 m-20 -88.11 110.11 20.4 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.283 -0.417 . . . . 73.31 111.217 174.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.618 HD12 HG23 ' A' ' 59' ' ' VAL . 41.2 mt -114.53 130.63 56.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.993 0.425 . . . . 72.34 110.847 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -87.29 118.03 26.44 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.83 0.348 . . . . 74.34 110.832 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t -95.15 146.37 24.36 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.323 0.582 . . . . 73.34 112.399 -176.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -89.51 2.72 54.21 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.904 -0.589 . . . . 74.2 111.387 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 -107.76 0.07 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.159 -0.543 . . . . 63.11 113.24 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -78.84 14.01 1.51 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 122.153 -0.616 . . . . 75.23 112.43 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.84 -5.13 49.78 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.007 -0.616 . . . . 61.14 113.788 177.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -78.7 146.78 33.78 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.974 0.416 . . . . 74.45 111.696 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -70.07 132.75 46.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.038 -0.528 . . . . 75.11 109.815 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.437 HG13 ' HB2' ' A' ' 48' ' ' LEU . 34.0 pt -103.48 118.11 50.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.126 0.489 . . . . 71.0 110.838 177.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -87.4 104.33 16.34 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.097 0.475 . . . . 74.42 109.741 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.618 HG23 HD12 ' A' ' 48' ' ' LEU . 90.3 t -94.39 119.74 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-O 121.105 0.479 . . . . 74.31 112.25 -172.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.2 m -106.7 121.97 45.41 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.994 -0.548 . . . . 73.05 111.29 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.445 HG22 HG13 ' A' ' 105' ' ' ILE . 36.9 pt -119.33 145.91 39.68 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 116.657 -0.247 . . . . 71.21 110.62 174.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.47 134.64 64.8 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.113 1.875 . . . . 75.21 112.261 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.76 -7.17 6.99 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.805 0.669 . . . . 65.25 112.805 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.5 p -70.46 -20.06 62.91 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 120.719 0.295 . . . . 54.53 110.883 173.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.5 t -82.1 133.47 51.07 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.981 -0.554 . . . . 65.21 110.747 175.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.64 151.19 7.9 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.14 2.56 . . . . 72.03 114.421 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 68.2 tp -63.96 136.34 57.26 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.926 -0.579 . . . . 73.32 112.197 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -92.52 125.21 37.06 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.15 0.5 . . . . 74.43 111.339 175.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -113.29 72.01 0.76 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.923 -0.58 . . . . 74.51 111.007 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -102.87 170.32 8.06 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.412 0.625 . . . . 75.23 111.856 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.6 168.34 10.59 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.54 -0.755 . . . . 74.31 111.496 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.23 130.68 44.05 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.912 0.387 . . . . 75.31 111.851 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.408 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 96.3 m-20 62.12 21.98 12.8 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.225 0.61 . . . . 71.31 112.222 -177.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.16 127.95 34.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.621 0.248 . . . . 70.12 111.038 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -62.05 116.26 4.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.125 0.488 . . . . 75.24 111.593 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.503 HG11 HD21 ' A' ' 107' ' ' LEU . 29.5 m -129.09 152.87 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.073 -0.512 . . . . 73.33 111.888 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.08 152.55 50.98 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.086 0.469 . . . . 74.43 110.461 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.0 mt -98.19 144.96 27.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.167 0.803 . . . . 75.24 113.167 -170.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.6 mm -92.37 113.51 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.378 -0.828 . . . . 75.44 110.31 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 48.3 67.69 4.25 Favored Pre-proline 0 N--CA 1.48 1.041 0 N-CA-C 112.776 0.658 . . . . 71.24 112.776 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.49 146.27 15.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.869 2.379 . . . . 71.42 113.429 177.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 46.8 pt -136.81 140.95 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 122.659 0.384 . . . . 72.52 111.002 176.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.35 124.9 25.31 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.188 -0.32 . . . . 73.3 110.709 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -64.17 104.63 0.76 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.469 0.652 . . . . 50.13 111.25 -175.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.8 t -81.31 -34.8 31.67 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.724 -0.671 . . . . 75.44 112.483 -178.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.465 ' O ' HG22 ' A' ' 90' ' ' THR . 21.6 m -70.14 -35.86 65.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 111.942 0.349 . . . . 74.12 111.942 -174.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.62 -54.36 46.88 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 111.724 0.268 . . . . 70.42 111.724 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.8 t -73.67 -26.51 60.77 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 111.872 0.323 . . . . 70.34 111.872 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.42 -40.9 98.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.816 0.341 . . . . 73.04 111.369 177.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 86' ' ' VAL . 10.2 t -90.68 -35.92 14.65 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.81 0.3 . . . . 73.55 111.81 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -104.97 99.1 8.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.943 0.402 . . . . 74.55 110.913 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -86.66 -5.69 59.06 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.493 -0.321 . . . . 74.01 111.844 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -75.03 161.17 53.18 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 121.251 -0.5 . . . . 73.25 113.235 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.49 -3.28 58.99 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.478 -0.425 . . . . 74.01 112.11 -178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -56.75 -45.02 82.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.772 0.429 . . . . 73.21 112.074 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 49.0 t -83.45 113.65 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 N-CA-C 112.109 0.411 . . . . 74.34 112.109 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -71.42 159.2 34.96 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 109.238 -0.653 . . . . 63.13 109.238 172.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.42 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -78.89 142.47 36.75 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 122.309 1.052 . . . . 75.53 113.681 -166.428 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -107.08 148.38 28.85 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.741 -1.118 . . . . 65.4 111.237 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 38.2 mt -123.53 113.54 37.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 110.052 -0.351 . . . . 75.21 110.052 174.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.44 ' HZ1' ' CD ' ' A' ' 43' ' ' GLU . 24.9 mtpp -85.35 132.64 34.21 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 122.224 -0.297 . . . . 72.4 110.691 -177.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -127.13 151.14 49.05 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.335 0.494 . . . . 72.53 112.335 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.16 -31.29 67.51 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.066 -0.515 . . . . 71.54 110.777 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -167.03 161.26 14.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.015 -0.539 . . . . 75.23 111.413 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.445 HG13 HG22 ' A' ' 61' ' ' ILE . 42.2 mt -122.83 116.71 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.356 -0.384 . . . . 75.31 111.174 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.2 m -124.35 171.32 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.903 0.383 . . . . 73.02 111.478 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.503 HD21 HG11 ' A' ' 76' ' ' VAL . 97.5 mt -75.62 145.34 41.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.479 -0.328 . . . . 74.05 110.809 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 m -65.8 148.66 51.42 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.663 0.268 . . . . 63.54 110.974 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 83.8 mt -64.66 0.76 1.01 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 112.728 0.64 . . . . 72.23 112.728 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.757 -0.64 . . . . 74.32 111.692 177.079 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.715 0.293 . . . . 75.41 111.112 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.49 ' N ' ' SD ' ' A' ' 2' ' ' MET . 1.1 mpt? -73.52 177.06 5.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.201 0.524 . . . . 65.52 111.313 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -93.46 89.32 6.26 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.198 0.523 . . . . 75.24 110.358 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.51 133.89 38.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.89 -0.595 . . . . 73.12 111.97 -176.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.5 ' HB3' ' HB2' ' A' ' 103' ' ' ASP . . . -84.36 95.5 8.76 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.943 0.402 . . . . 71.22 111.559 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -96.13 116.31 28.78 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.922 0.391 . . . . 74.4 111.443 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -152.55 62.82 0.38 Allowed Glycine 0 CA--C 1.527 0.836 0 CA-C-N 115.846 -0.615 . . . . 73.51 112.104 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 27.5 pt -62.6 128.61 24.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.302 0.572 . . . . 75.54 112.211 -177.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 12.7 p -141.25 160.33 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.166 -0.47 . . . . 71.43 111.315 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.458 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.2 pt? -116.8 -49.36 2.63 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.682 0.277 . . . . 73.23 111.162 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.2 122.16 29.81 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 110.002 -0.37 . . . . 65.53 110.002 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -152.14 126.59 9.38 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.285 0.564 . . . . 71.23 112.096 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -86.59 122.98 31.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.732 -0.667 . . . . 65.24 111.181 -178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.9 p -72.49 69.03 0.83 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.395 0.617 . . . . 75.03 111.522 176.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -80.63 -35.85 33.39 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.066 -0.515 . . . . 70.13 111.641 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -76.06 112.28 12.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.752 0.311 . . . . 72.12 111.188 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 170.08 19.5 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.777 -0.725 . . . . 74.1 112.124 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -45.14 108.28 0.12 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.342 0.497 . . . . 74.1 112.342 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 92.1 mt -77.38 133.03 38.8 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.133 -0.485 . . . . 75.42 110.643 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.499 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 7.1 mtmp? -136.21 140.82 43.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.52 -0.309 . . . . 73.23 111.305 -176.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -65.4 135.48 55.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.095 0.406 . . . . 73.14 112.095 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.0 m -116.14 -63.96 1.38 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.835 0.35 . . . . 73.01 111.428 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.26 -173.68 4.15 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.043 0.449 . . . . 72.4 111.747 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.6 tp -102.09 127.24 49.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.393 -0.367 . . . . 61.52 110.177 171.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -79.63 -68.47 0.66 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.969 0.414 . . . . 75.4 111.951 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -163.42 145.6 9.8 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.275 0.472 . . . . 71.55 112.275 -171.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -106.67 103.1 12.46 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.286 -0.416 . . . . 63.32 110.911 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 m -76.6 109.98 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.344 0.592 . . . . 63.32 111.172 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 70.0 mtp180 -92.67 170.43 9.72 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.2 -0.455 . . . . 70.25 111.957 -174.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.41 ' HB ' ' HB3' ' A' ' 38' ' ' SER . 48.6 mt -80.82 144.18 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.484 -0.325 . . . . 74.54 111.1 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -110.48 133.25 53.46 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.767 0.318 . . . . 64.45 111.028 176.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.5 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.6 m-20 -79.68 162.43 25.23 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.49 0.552 . . . . 74.03 112.49 -175.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.89 -38.71 67.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.73 -0.668 . . . . 70.12 110.869 174.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.25 -37.44 67.22 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.534 -0.757 . . . . 73.41 111.539 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.25 -32.18 4.99 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 116.061 -0.518 . . . . 60.31 111.952 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 54.8 m -62.7 166.54 5.33 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.055 0.455 . . . . 75.12 111.737 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.31 146.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.933 0.397 . . . . 73.14 111.507 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.5 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 32.7 t -94.65 156.62 16.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.093 0.473 . . . . 72.44 111.508 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.432 ' HA ' ' NH2' ' A' ' 29' ' ' ARG . 13.5 t70 -67.06 -31.56 72.15 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.177 -0.465 . . . . 73.22 111.043 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.401 ' HB2' HD11 ' A' ' 30' ' ' ILE . 16.9 mm-40 -73.45 152.53 40.73 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.434 0.635 . . . . 73.51 112.008 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 56.9 mt -114.56 147.17 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.972 -0.558 . . . . 74.14 111.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.57 -60.51 2.23 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.064 0.459 . . . . 73.11 111.411 176.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -147.04 167.44 24.06 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.105 -0.498 . . . . 73.35 111.019 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -128.93 118.21 22.26 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.243 -0.435 . . . . 73.04 110.739 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.2 m -95.76 124.97 40.02 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.385 0.513 . . . . 72.32 112.385 -175.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -106.4 167.87 9.54 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.086 0.47 . . . . 72.53 111.568 177.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -112.38 116.15 29.87 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.78 -0.646 . . . . 74.25 111.031 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.3 mt -121.6 121.06 36.57 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 73.21 111.238 178.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 56' ' ' MET . 20.2 ptmt -96.45 128.47 43.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.395 0.617 . . . . 73.43 111.603 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.9 t -88.63 150.37 23.06 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.175 0.512 . . . . 74.44 111.893 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -78.37 118.8 20.89 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.945 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 143.14 -77.84 0.28 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.335 -0.459 . . . . 72.11 112.393 -177.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -95.52 -5.66 42.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.046 0.387 . . . . 72.32 112.046 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.97 0.9 54.33 Favored Glycine 0 CA--C 1.532 1.11 0 N-CA-C 114.448 0.539 . . . . 65.11 114.448 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 -79.43 153.98 29.28 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 117.282 0.541 . . . . 74.41 111.582 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.488 ' HA ' ' HA ' ' A' ' 49' ' ' LYS . 22.8 ptp -105.45 144.11 32.68 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.903 -0.59 . . . . 74.22 111.441 176.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.51 HD12 HD11 ' A' ' 100' ' ' ILE . 24.0 pt -106.06 144.62 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 116.103 -0.499 . . . . 74.33 110.598 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -87.74 105.43 17.38 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.836 0.35 . . . . 62.53 111.017 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -101.1 119.62 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 N-CA-C 112.218 0.451 . . . . 75.03 112.218 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.538 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 39.2 m -106.79 129.13 54.7 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.989 0.423 . . . . 43.13 111.623 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.9 pt -126.7 149.85 69.52 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 116.508 -0.315 . . . . 64.41 110.645 174.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -55.69 141.82 83.54 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.486 2.124 . . . . 74.42 112.843 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.27 -18.13 34.74 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.59 0.589 . . . . 65.23 112.59 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 45.1 t -62.38 -27.95 69.43 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.851 0.358 . . . . 74.12 111.484 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.7 t -77.08 128.58 80.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 116.512 -0.313 . . . . 73.25 111.034 178.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 155.42 33.45 Favored 'Trans proline' 0 CA--C 1.544 1.008 0 C-N-CA 122.797 2.331 . . . . 72.25 113.667 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.53 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 26.7 tp -67.89 134.42 50.82 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.095 -0.502 . . . . 71.13 111.749 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.413 ' H ' HD12 ' A' ' 67' ' ' LEU . 61.1 mmtt -83.74 -70.99 0.53 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.844 0.683 . . . . 74.33 112.844 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.53 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 50.6 mt-10 55.6 49.85 15.68 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 120.702 0.287 . . . . 71.43 111.608 -175.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -66.65 169.56 7.6 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.119 0.485 . . . . 75.23 112.072 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.53 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 3.9 m-20 -60.66 138.3 58.09 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.994 -0.548 . . . . 74.22 111.061 176.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -62.68 125.31 23.51 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 116.389 -0.369 . . . . 71.01 111.615 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 69.32 17.63 8.18 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.593 0.757 . . . . 70.21 112.914 -176.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.53 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -80.21 146.33 31.79 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.991 -0.443 . . . . 71.21 111.265 175.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.462 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 75.4 mtt180 -69.99 114.81 8.52 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.046 0.45 . . . . 74.43 111.681 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.526 HG13 HD23 ' A' ' 107' ' ' LEU . 27.4 m -126.93 140.42 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.075 -0.511 . . . . 74.33 111.146 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.7 pt-20 -121.66 155.9 34.16 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.242 0.544 . . . . 74.43 111.331 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -98.86 122.14 41.72 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.373 0.509 . . . . 72.5 112.373 -174.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -72.5 108.53 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 115.956 -0.565 . . . . 74.21 110.331 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 55.57 67.02 3.27 Favored Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 112.817 0.673 . . . . 74.11 112.817 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.87 137.7 10.03 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.778 2.318 . . . . 74.52 113.633 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 101' ' ' LYS . 40.1 pt -120.59 141.95 38.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 121.029 0.442 . . . . 74.0 110.995 174.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.72 129.0 36.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.611 -0.268 . . . . 73.45 110.468 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.435 ' OD1' HG23 ' A' ' 86' ' ' VAL . 7.1 t0 -73.08 132.64 43.57 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.277 0.56 . . . . 74.22 111.998 -174.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 32.5 m -67.21 -42.5 84.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.797 -0.638 . . . . 72.22 112.411 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.435 HG23 ' OD1' ' A' ' 84' ' ' ASP . 16.6 m -60.24 -16.93 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 112.183 0.438 . . . . 73.34 112.183 -174.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -106.08 -56.66 2.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.961 0.41 . . . . 73.35 111.679 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.1 p -68.46 -15.46 63.56 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.773 0.657 . . . . 71.34 112.773 -175.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.43 9.62 35.6 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.896 0.379 . . . . 73.21 111.848 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.7 m -120.28 -32.86 4.03 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.173 0.511 . . . . 71.32 110.829 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.635 ' HB3' ' HB2' ' A' ' 94' ' ' ALA . 49.3 m-85 -93.32 113.8 26.07 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.079 -0.51 . . . . 75.42 111.477 177.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -61.72 96.67 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.554 -0.293 . . . . 72.42 111.767 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 53.5 32.26 45.43 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.416 -0.356 . . . . 55.13 113.793 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.635 ' HB2' ' HB3' ' A' ' 91' ' ' TYR . . . -121.64 114.03 20.58 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.074 0.464 . . . . 62.32 111.954 -177.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -84.98 31.36 0.55 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.063 0.459 . . . . 74.14 111.725 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.48 HG21 ' HB1' ' A' ' 94' ' ' ALA . 59.4 t -63.42 99.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 112.419 0.525 . . . . 73.51 112.419 -174.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 54.74 33.94 20.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.224 0.535 . . . . 75.25 111.886 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.85 160.68 19.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.754 1.02 . . . . 75.45 113.754 -174.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -107.32 143.92 34.91 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.828 -1.078 . . . . 74.34 111.614 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.51 HD11 HD12 ' A' ' 57' ' ' ILE . 63.2 mt -131.87 131.68 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.976 -0.556 . . . . 72.44 110.315 176.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.538 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 32.9 mtmm -109.14 126.03 52.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.761 0.315 . . . . 75.1 111.228 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.76 162.95 16.88 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.5 0.556 . . . . 72.45 112.5 -173.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.5 ' HB2' ' HB3' ' A' ' 5' ' ' ALA . 32.1 t70 -73.27 -29.15 62.54 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.583 -0.735 . . . . 73.44 110.542 176.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -174.45 162.63 3.53 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.995 -0.548 . . . . 74.32 111.266 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 34.2 mt -118.98 119.92 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.44 -0.345 . . . . 71.53 110.665 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.72 174.13 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-O 120.905 0.384 . . . . 74.22 111.834 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.526 HD23 HG13 ' A' ' 76' ' ' VAL . 95.0 mt -77.53 132.29 38.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.66 -0.246 . . . . 74.33 111.023 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.462 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 87.6 m -55.78 141.41 38.62 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.108 0.41 . . . . 73.34 112.108 -177.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.65 85.65 0.11 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.09 0.471 . . . . 71.33 111.642 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-N 116.377 -0.374 . . . . 74.23 111.414 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.64 0.257 . . . . 71.43 111.416 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.423 ' N ' ' SD ' ' A' ' 2' ' ' MET . 1.3 mpt? -77.37 100.02 5.79 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.668 0.618 . . . . 74.42 112.668 -176.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -122.89 140.25 53.17 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.483 -0.326 . . . . 72.23 110.896 171.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.422 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.1 mm? -99.0 147.72 24.73 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.663 0.268 . . . . 75.23 110.838 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -94.92 119.3 33.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.778 0.323 . . . . 70.11 111.439 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -68.12 -39.46 82.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.854 0.359 . . . . 74.05 111.698 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.71 94.23 1.15 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.252 -0.499 . . . . 62.33 113.538 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.6 pt -97.56 167.89 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 120.973 0.416 . . . . 63.44 111.227 176.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.11 108.39 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.987 0.422 . . . . 73.12 111.262 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.781 HD12 ' HG2' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -145.61 171.26 14.96 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.194 -0.457 . . . . 73.12 111.937 -179.227 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -104.88 22.53 15.04 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.491 0.552 . . . . 73.32 112.491 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.781 ' HG2' HD12 ' A' ' 10' ' ' LEU . 13.6 ptmm? -62.43 -40.1 95.47 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.404 0.52 . . . . 73.44 112.404 -176.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -100.68 112.45 24.84 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.075 0.464 . . . . 74.43 111.588 -177.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -84.99 -170.27 3.05 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.175 -0.466 . . . . 75.31 111.956 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -87.01 139.78 30.23 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.009 0.433 . . . . 73.52 112.113 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -97.46 163.78 12.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.274 -0.421 . . . . 70.14 111.201 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.85 -151.6 9.14 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.982 -0.627 . . . . 72.05 112.71 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.488 ' HG2' ' HG3' ' A' ' 51' ' ' LYS . 11.6 pt-20 -62.73 109.04 1.29 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.41 0.624 . . . . 74.33 111.255 178.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.8 mt -80.37 119.16 22.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.435 . . . . 74.23 110.189 175.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.622 ' HZ1' ' HB3' ' A' ' 20' ' ' LYS . 9.0 mtpm? -101.63 120.88 41.02 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.129 0.49 . . . . 75.45 111.729 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 35.7 t80 -59.34 115.21 3.09 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.454 -0.793 . . . . 74.54 110.371 173.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.461 ' OG ' ' HG2' ' A' ' 49' ' ' LYS . 49.7 m -98.69 -64.42 1.04 Allowed 'General case' 0 N--CA 1.474 0.735 0 O-C-N 122.12 -0.362 . . . . 72.41 111.958 -178.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.28 176.96 11.12 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.287 0.565 . . . . 74.31 112.257 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.3 tp -91.25 107.32 19.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.809 -0.632 . . . . 73.32 110.513 175.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -61.66 -59.2 5.55 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.43 -0.35 . . . . 75.51 111.7 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -173.26 130.51 0.47 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.508 0.559 . . . . 74.41 112.508 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -98.58 99.54 10.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.99 -0.55 . . . . 73.42 110.102 171.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 m -77.71 115.54 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.027 0.442 . . . . 70.54 111.285 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.555 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 78.8 mtt85 -87.29 168.45 13.18 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.265 0.555 . . . . 74.42 112.153 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.3 mt -79.4 122.15 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 74.44 111.786 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.441 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -91.94 112.59 24.58 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.9 0.381 . . . . 73.21 111.035 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -59.17 162.88 4.1 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.64 0.608 . . . . 65.12 112.64 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.35 -32.7 57.46 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 116.171 -0.468 . . . . 70.3 111.345 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.14 -7.26 22.05 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.493 0.553 . . . . 54.3 112.493 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 93.33 -10.28 73.42 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.234 -0.508 . . . . 73.24 113.27 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -93.4 145.41 24.5 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.39 -0.476 . . . . 63.3 111.518 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 28.9 t -75.49 151.72 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.525 -0.307 . . . . 74.54 111.521 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -105.1 170.99 7.56 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.09 0.471 . . . . 72.4 111.679 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.26 -28.25 64.02 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.993 -0.549 . . . . 75.34 110.945 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -74.96 146.15 41.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.313 0.577 . . . . 74.22 112.225 -177.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 51.3 mt -99.0 153.63 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 115.655 -0.702 . . . . 74.54 111.348 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.438 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 24.0 tptm -108.83 -58.64 1.99 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.859 0.362 . . . . 74.04 111.359 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.6 mt-10 -136.33 139.97 42.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.057 0.456 . . . . 72.53 111.286 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -107.53 112.43 25.19 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 116.347 -0.388 . . . . 74.31 111.203 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.6 m -103.64 122.23 44.58 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.702 0.63 . . . . 72.23 112.702 -177.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -105.83 161.16 14.67 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.341 0.656 . . . . 75.32 111.574 175.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -108.41 116.23 31.58 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.321 -0.4 . . . . 74.43 110.899 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.633 HD12 HG21 ' A' ' 59' ' ' VAL . 65.5 mt -113.12 144.4 42.7 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.699 0.285 . . . . 74.44 110.747 176.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG2' ' OG ' ' A' ' 22' ' ' SER . 14.7 mmmm -102.4 126.13 49.33 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.779 0.324 . . . . 72.42 111.314 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m -81.75 121.68 26.71 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 74.23 111.608 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.488 ' HG3' ' HG2' ' A' ' 18' ' ' GLU . 14.6 tmtt? -54.04 146.4 14.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.758 0.423 . . . . 74.12 112.024 179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.58 -51.56 4.59 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.231 -0.509 . . . . 71.3 113.343 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -85.86 -31.79 22.05 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 120.876 0.37 . . . . 75.43 111.337 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 61.3 34.53 88.54 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 121.431 -0.414 . . . . 52.5 113.308 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -104.42 152.55 22.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.547 -0.384 . . . . 74.41 111.099 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.9 ptp -95.11 114.18 25.95 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 121.121 0.486 . . . . 74.11 112.218 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.513 HD11 HD12 ' A' ' 100' ' ' ILE . 28.9 pt -99.01 135.67 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.307 -0.406 . . . . 75.51 110.654 175.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.0 mp0 -87.05 104.28 16.17 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.933 0.397 . . . . 71.44 110.637 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.633 HG21 HD12 ' A' ' 48' ' ' LEU . 91.9 t -94.94 114.23 31.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.954 0.407 . . . . 74.11 111.423 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.457 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 29.5 t -107.52 131.49 54.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.098 0.475 . . . . 75.11 111.693 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.9 pt -123.51 147.86 54.02 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 115.947 -0.57 . . . . 74.45 111.313 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -53.27 151.4 22.63 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.999 2.466 . . . . 73.24 113.911 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.02 -47.65 61.61 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.664 0.987 . . . . 75.11 113.664 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.5 m -70.49 -4.12 21.22 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.906 0.706 . . . . 75.03 112.906 -174.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.25 119.84 77.71 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 120.581 0.229 . . . . 75.33 110.496 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.18 142.94 44.02 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.942 2.428 . . . . 61.23 113.693 -176.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.99 128.58 36.18 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.041 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -79.35 -63.7 1.36 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.407 0.521 . . . . 73.14 112.407 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 58.64 48.97 10.95 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 112.625 0.602 . . . . 72.51 112.625 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -75.99 -166.01 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.054 0.454 . . . . 75.23 112.071 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -91.48 158.74 16.31 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.406 0.521 . . . . 73.34 112.406 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.445 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.6 t80 -60.12 -22.1 62.4 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.891 0.701 . . . . 74.22 112.891 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.421 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 15.3 m120 -114.54 20.88 15.02 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.883 -0.511 . . . . 74.22 111.308 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.63 117.61 20.7 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.865 0.364 . . . . 63.4 111.734 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.608 ' NH2' ' HG3' ' A' ' 110' ' ' GLU . 49.9 mtp180 -73.53 111.28 8.52 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.282 -0.417 . . . . 75.34 111.008 177.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.512 HG13 HD23 ' A' ' 107' ' ' LEU . 34.6 m -117.41 159.32 17.63 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.286 0.565 . . . . 52.3 112.401 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -135.85 152.55 51.17 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.217 -0.447 . . . . 65.05 110.979 173.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.5 mt -100.73 138.54 37.64 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.552 0.575 . . . . 61.21 112.552 -173.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.21 111.54 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.883 -0.598 . . . . 75.14 110.698 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 47.04 70.26 2.19 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.958 0.725 . . . . 61.43 112.958 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.33 151.95 17.91 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.982 2.455 . . . . 64.45 113.668 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 pt -141.1 139.99 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.22 -0.446 . . . . 73.42 111.054 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -89.24 102.71 15.37 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.675 0.274 . . . . 73.24 111.021 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.14 166.57 23.28 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.006 0.431 . . . . 75.34 111.54 -174.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.8 t -126.52 -4.26 6.61 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.734 0.642 . . . . 72.04 112.734 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -54.11 -21.81 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.945 0.72 . . . . 74.14 112.945 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.35 -47.85 69.21 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.911 0.386 . . . . 75.3 111.287 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.2 p -74.26 -10.63 59.79 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.8 0.296 . . . . 71.54 111.8 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.01 -38.96 72.65 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.862 0.363 . . . . 73.01 111.314 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.8 p -83.69 -42.94 16.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.241 0.543 . . . . 74.11 110.79 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -64.91 158.86 24.15 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.437 0.637 . . . . 73.52 111.847 176.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 92' ' ' GLN . 17.3 tt0 -88.19 21.14 2.9 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.388 0.613 . . . . 70.21 110.075 174.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 73.29 31.24 61.54 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.348 -0.453 . . . . 75.34 112.495 -172.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.31 -51.66 5.32 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.526 0.565 . . . . 73.13 112.526 -175.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -114.8 161.58 18.01 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.852 0.358 . . . . 72.2 111.607 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.2 m -120.01 26.76 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 113.224 0.824 . . . . 75.44 113.224 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.02 96.25 0.31 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 109.304 -0.628 . . . . 71.34 109.304 170.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -121.52 159.45 26.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.787 1.032 . . . . 74.35 113.787 -165.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 34.7 m-85 -115.65 129.11 56.37 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.726 -1.124 . . . . 75.02 112.793 -174.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 55.7 mt -104.14 108.02 23.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.998 -0.546 . . . . 75.53 109.728 169.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 52.0 mtpt -93.48 138.49 31.72 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.501 -0.318 . . . . 75.23 111.464 -174.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.31 171.86 13.86 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.546 0.572 . . . . 62.44 112.546 -175.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 -42.55 40.71 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.712 -0.676 . . . . 74.41 111.252 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -163.95 158.62 19.89 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.164 -0.471 . . . . 74.31 111.07 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.534 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 42.1 mt -116.57 115.84 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 116.53 -0.305 . . . . 75.43 110.936 -179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.91 179.08 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 120.838 0.351 . . . . 72.33 111.314 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG13 ' A' ' 76' ' ' VAL . 97.9 mt -86.31 142.21 28.68 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.687 0.28 . . . . 74.23 110.889 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.695 HG22 ' HG2' ' A' ' 110' ' ' GLU . 1.8 m -68.26 120.26 14.13 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.389 . . . . 74.41 110.975 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 75.0 mt -81.94 34.16 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.218 0.821 . . . . 74.42 113.218 -171.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.695 ' HG2' HG22 ' A' ' 108' ' ' THR . 6.3 pt-20 . . . . . 0 C--O 1.256 1.442 0 CA-C-O 119.491 -0.29 . . . . 72.45 111.386 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.5 mtm . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.439 0.162 . . . . 74.12 111.071 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -128.14 112.75 14.9 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.224 0.535 . . . . 74.54 110.841 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 3' ' ' ARG . 37.5 ttp180 -91.6 88.7 6.85 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 73.41 110.921 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -152.35 164.71 36.91 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.796 -0.638 . . . . 75.3 111.189 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -168.98 114.69 0.59 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.992 0.367 . . . . 74.51 111.992 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -150.56 157.27 42.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.185 0.517 . . . . 53.41 111.632 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -136.51 -26.74 0.41 Allowed Glycine 0 CA--C 1.527 0.834 0 CA-C-N 116.171 -0.468 . . . . 63.31 112.682 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.9 pt -87.04 170.55 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-O 120.952 0.406 . . . . 75.14 111.303 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.2 t -90.28 89.21 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.161 0.505 . . . . 73.34 110.356 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.471 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -79.22 -24.3 43.19 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.324 -0.398 . . . . 74.33 111.878 -177.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -93.9 -169.17 2.03 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 122.288 -0.258 . . . . 54.31 111.069 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 12' ' ' LYS . 72.5 mmtt -109.53 -36.06 6.07 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.612 0.967 . . . . 73.03 113.612 -173.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.7 95.8 0.11 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.324 0.583 . . . . 75.13 111.849 -177.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.2 p -87.99 12.48 13.24 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.91 -0.587 . . . . 73.25 111.969 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.1 m -67.88 140.28 56.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.876 0.37 . . . . 73.14 111.251 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HD1' HE21 ' A' ' 53' ' ' GLN . 17.1 m-85 -76.61 27.08 0.13 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 120.794 0.33 . . . . 73.42 111.848 -175.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.2 -112.5 3.59 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 121.218 -0.515 . . . . 74.41 112.266 -174.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.35 131.72 51.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.955 0.407 . . . . 64.32 110.994 176.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.1 mt -92.98 128.35 38.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.608 -0.515 . . . . 74.34 109.608 174.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 mtpt -101.66 115.71 31.12 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.155 0.503 . . . . 75.23 110.802 -174.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.439 ' HA ' ' CD2' ' A' ' 48' ' ' LEU . 51.6 t80 -60.17 143.77 51.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.408 -0.814 . . . . 74.04 112.536 -174.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.557 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 34.3 t -121.3 -66.39 1.05 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.851 0.315 . . . . 62.3 111.851 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.91 178.01 9.29 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.027 0.441 . . . . 54.1 112.181 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.438 HD22 HD13 ' A' ' 67' ' ' LEU . 58.6 tp -94.6 107.46 19.45 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.795 -0.446 . . . . 73.44 109.795 170.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.23 -60.29 3.15 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.277 0.473 . . . . 74.42 112.277 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -165.86 138.08 4.01 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.161 0.43 . . . . 74.24 112.161 -175.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -96.51 101.83 13.52 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.284 -0.416 . . . . 71.11 110.079 172.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.3 m -69.83 125.92 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.118 0.485 . . . . 73.54 111.234 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 29' ' ' ARG . 65.2 mtt85 -104.88 151.97 23.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.433 0.635 . . . . 73.5 112.373 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -66.81 122.03 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.083 -0.962 . . . . 74.34 112.438 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -99.27 132.82 44.33 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.425 -0.352 . . . . 72.34 111.048 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -86.11 169.66 12.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.498 0.555 . . . . 74.24 112.498 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -59.12 -35.79 74.06 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.559 -0.746 . . . . 73.13 111.499 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -60.49 -28.46 68.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.104 -0.498 . . . . 64.52 112.015 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.73 -29.67 7.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 121.177 -0.535 . . . . 63.32 112.368 -174.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.9 m -65.18 143.29 57.95 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.07 0.462 . . . . 74.23 111.62 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.79 135.48 35.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.057 0.456 . . . . 75.01 111.763 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.3 t -82.53 158.08 23.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.828 -0.624 . . . . 73.34 111.506 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -74.43 -8.13 55.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.135 0.493 . . . . 62.44 110.835 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.09 132.45 43.32 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.865 -0.607 . . . . 71.01 110.893 175.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.7 mt -97.99 148.6 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 120.835 0.35 . . . . 74.15 111.497 -175.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -102.73 -57.44 2.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.75 0.309 . . . . 74.04 111.068 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.02 151.97 44.5 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.884 0.373 . . . . 74.35 111.218 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -116.67 117.14 28.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.231 0.539 . . . . 74.32 111.27 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.1 m -91.48 123.52 34.96 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 73.42 112.584 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.495 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.5 m-85 -104.36 148.03 26.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.036 0.534 . . . . 74.24 110.943 174.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -94.5 120.9 35.44 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.839 0.352 . . . . 75.54 110.867 174.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.54 HD12 HG23 ' A' ' 59' ' ' VAL . 63.4 mt -123.55 145.72 48.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.708 0.289 . . . . 75.24 110.821 177.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.557 ' HE2' ' HB2' ' A' ' 22' ' ' SER . 0.0 OUTLIER -112.3 141.64 45.78 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.989 0.424 . . . . 65.15 111.007 174.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p -106.87 155.44 19.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 73.23 111.822 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -90.94 157.23 17.43 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.91 0.386 . . . . 74.44 111.318 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.32 -61.46 3.86 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.979 -0.629 . . . . 71.41 112.031 -176.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.41 HE21 ' HD1' ' A' ' 16' ' ' PHE . 2.8 mp0 -71.3 -24.34 62.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.367 0.267 . . . . 75.35 110.847 173.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.76 42.51 45.91 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 116.042 -0.526 . . . . 71.02 114.249 173.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -138.91 168.47 19.75 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.911 0.386 . . . . 75.12 111.543 -175.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptm -95.39 148.26 22.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.516 0.675 . . . . 74.5 111.892 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.533 HD13 HD11 ' A' ' 100' ' ' ILE . 22.5 pt -130.78 150.88 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 115.414 -0.812 . . . . 72.53 109.759 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -107.01 105.35 15.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.205 -0.998 . . . . 71.35 111.32 177.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.54 HG23 HD12 ' A' ' 48' ' ' LEU . 84.7 t -94.72 121.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.307 -0.406 . . . . 75.54 111.303 -177.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.532 ' OG ' ' HG2' ' A' ' 101' ' ' LYS . 91.3 p -113.63 131.75 56.02 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.418 0.628 . . . . 72.05 111.503 -178.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.9 pt -122.86 145.4 45.43 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.724 -0.671 . . . . 72.11 110.302 175.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.82 147.74 17.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.45 2.1 . . . . 75.53 113.231 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.2 -22.71 63.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.882 0.372 . . . . 64.13 111.701 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 57.5 p -65.51 -21.38 66.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.305 -0.407 . . . . 74.12 111.742 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.3 t -85.54 124.5 71.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-N 116.562 -0.29 . . . . 74.43 110.939 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.92 159.45 7.22 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.161 2.574 . . . . 72.43 114.617 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.527 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 45.2 tp -75.4 128.42 35.33 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.981 -0.554 . . . . 74.13 111.186 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.451 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.92 -64.26 1.2 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.942 0.719 . . . . 74.01 112.942 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.527 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.7 mt-10 57.02 52.66 8.9 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.843 0.683 . . . . 72.42 112.843 -178.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.48 173.0 9.45 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.006 -0.434 . . . . 75.43 111.464 173.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.16 160.57 31.85 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.974 0.416 . . . . 74.44 111.845 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -71.2 134.46 46.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.941 -0.392 . . . . 73.41 109.941 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 68.52 12.66 8.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.983 0.513 . . . . 75.35 112.153 -175.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.49 136.96 54.0 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.88 0.372 . . . . 71.3 111.576 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -78.27 104.59 8.95 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.439 -0.346 . . . . 74.31 110.873 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.512 HG11 HD23 ' A' ' 107' ' ' LEU . 32.5 m -124.62 154.62 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 121.311 0.577 . . . . 62.54 111.955 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -130.01 155.69 45.7 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.26 0.552 . . . . 73.22 110.866 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.2 mt -103.04 139.28 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.529 0.68 . . . . 75.14 112.421 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.6 mm -85.06 106.66 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.581 -0.736 . . . . 73.13 110.518 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 54.6 68.57 2.57 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.335 0.494 . . . . 73.02 112.335 -176.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.04 130.8 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.724 2.282 . . . . 72.52 113.452 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 pt -124.91 142.97 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.734 0.302 . . . . 75.31 111.317 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.66 115.78 26.44 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.6 0.238 . . . . 73.21 110.914 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.13 165.16 25.66 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.168 0.509 . . . . 71.43 111.226 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.0 m -150.27 -37.17 0.15 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.953 0.406 . . . . 73.14 111.265 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.76 6.32 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 112.787 0.662 . . . . 74.12 112.787 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -48.53 -48.24 38.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.399 0.518 . . . . 74.45 112.399 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.8 t -59.34 -15.61 17.4 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.618 0.599 . . . . 73.02 112.618 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -109.22 -21.05 12.74 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.569 0.581 . . . . 72.4 112.569 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 60.0 p -98.36 -43.1 7.06 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.572 0.582 . . . . 74.41 112.572 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -78.81 -80.67 0.11 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.765 0.284 . . . . 71.34 111.765 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -142.89 -49.03 0.33 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.339 0.496 . . . . 73.22 112.339 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 153.82 -32.22 0.74 Allowed Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.274 -0.965 . . . . 71.41 113.854 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.59 10.48 9.02 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 122.42 -0.459 . . . . 65.01 111.718 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -96.79 94.41 7.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.009 -0.542 . . . . 74.3 111.112 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.48 -33.27 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 112.826 0.676 . . . . 74.35 112.826 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.34 130.13 45.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.734 0.302 . . . . 64.1 110.28 175.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.521 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -62.77 108.36 1.16 Allowed 'General case' 0 C--O 1.259 1.562 0 CA-C-O 122.84 1.305 . . . . 74.34 114.275 -165.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.672 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 80.1 m-85 -84.86 112.81 20.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 113.377 -1.738 . . . . 75.03 110.418 169.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.533 HD11 HD13 ' A' ' 57' ' ' ILE . 30.4 mt -90.43 104.34 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.3 0.571 . . . . 74.31 109.698 177.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.532 ' HG2' ' OG ' ' A' ' 60' ' ' SER . 96.5 mttt -85.21 131.5 34.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 65.34 111.618 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.93 155.62 45.76 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.177 0.513 . . . . 73.5 112.194 -177.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -68.83 -39.14 80.14 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.753 -0.658 . . . . 65.13 110.94 176.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -164.31 162.09 22.19 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.029 -0.532 . . . . 74.1 111.422 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.451 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 39.9 mt -118.75 115.93 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.363 -0.38 . . . . 74.22 111.077 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -125.01 170.52 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-O 120.743 0.306 . . . . 73.21 111.682 -178.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG11 ' A' ' 76' ' ' VAL . 95.2 mt -72.15 139.09 48.12 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 75.31 110.921 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -57.79 125.08 21.47 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.605 -0.271 . . . . 74.11 111.722 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 80.6 mt -58.12 92.47 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.897 0.38 . . . . 72.11 110.013 174.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 C--O 1.253 1.282 0 CA-C-O 118.363 -0.827 . . . . 74.04 112.599 -175.616 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.769 0.319 . . . . 74.25 111.369 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 62.1 mtt -86.7 164.56 16.69 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.123 0.487 . . . . 72.3 111.331 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.435 ' HA ' ' NE ' ' A' ' 3' ' ' ARG . 6.1 mmp_? -106.5 162.9 13.32 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.022 0.439 . . . . 73.44 110.271 169.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.411 ' N ' HD21 ' A' ' 4' ' ' LEU . 3.2 mm? -94.8 122.48 37.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.248 0.547 . . . . 71.12 111.431 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.51 147.45 39.77 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.8 0.667 . . . . 73.42 112.8 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -85.3 24.61 1.11 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.702 -0.681 . . . . 74.21 111.662 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.72 95.08 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.557 -0.354 . . . . 71.2 113.334 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.24 140.68 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.194 0.521 . . . . 72.5 111.287 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -97.72 114.89 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.261 -0.427 . . . . 75.12 111.225 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 pp -120.54 173.71 7.01 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.061 0.457 . . . . 75.4 111.515 178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -111.4 -92.81 0.46 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 122.269 -0.269 . . . . 73.22 110.644 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.581 ' HZ1' ' HB3' ' A' ' 12' ' ' LYS . 7.2 ttpm? 177.39 98.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.76 -0.83 . . . . 74.41 108.76 175.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -58.51 101.35 0.08 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.175 0.806 . . . . 74.31 113.175 -172.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.1 t -62.11 -17.01 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.874 -0.603 . . . . 44.14 111.07 172.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.488 ' O ' ' HA3' ' A' ' 52' ' ' GLY . 86.7 m -64.77 -22.29 66.95 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.858 -0.61 . . . . 65.4 110.928 173.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -123.51 91.71 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.336 -0.393 . . . . 74.13 112.058 -179.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.73 -178.93 8.31 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 120.667 -0.778 . . . . 54.12 111.578 168.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -54.34 137.77 41.01 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.11 0.955 . . . . 62.15 112.161 -177.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 70.0 mt -86.13 170.94 11.73 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.62 -0.718 . . . . 72.44 111.278 -175.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.691 ' HG2' ' HA ' ' A' ' 73' ' ' ASN . 0.2 OUTLIER -158.49 133.31 8.31 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.002 0.43 . . . . 74.43 111.894 -179.606 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.461 ' HA ' HD23 ' A' ' 48' ' ' LEU . 36.1 t80 -72.74 143.99 47.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.118 -0.492 . . . . 75.35 111.566 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 t -125.03 -65.39 1.03 Allowed 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.348 -0.22 . . . . 64.24 111.413 174.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.16 -173.84 4.06 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.916 0.388 . . . . 64.31 112.039 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.4 tp -94.94 133.08 39.08 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.806 0.336 . . . . 74.45 111.134 174.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -88.29 -65.06 1.06 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.837 0.351 . . . . 75.1 111.836 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -164.32 142.93 7.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.846 0.355 . . . . 70.12 111.698 -176.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -106.59 98.98 8.59 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.871 -0.418 . . . . 75.32 109.871 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.42 ' O ' HG23 ' A' ' 28' ' ' VAL . 28.8 m -71.8 92.3 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 121.864 0.84 . . . . 74.32 111.352 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 41' ' ' ILE . 71.5 mtt180 -83.34 159.45 21.86 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.583 -0.735 . . . . 74.42 112.344 -177.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.9 mt -81.01 132.93 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.56 -0.745 . . . . 74.41 110.911 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -110.57 128.17 55.54 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.837 0.351 . . . . 75.14 110.536 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -67.79 153.39 43.82 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.638 0.606 . . . . 72.42 112.638 -173.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.95 -36.94 60.58 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.281 0.563 . . . . 55.25 110.742 172.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -51.05 -42.65 60.66 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.377 -0.829 . . . . 61.15 111.617 175.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.95 -39.98 1.64 Allowed Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.367 -0.444 . . . . 64.43 112.55 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.5 m -68.98 148.27 50.38 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.183 0.516 . . . . 73.34 111.938 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.64 137.73 20.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.081 -0.509 . . . . 64.12 111.673 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -88.6 166.92 13.8 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.108 0.48 . . . . 72.15 111.727 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -87.81 -7.62 57.03 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.359 -0.382 . . . . 64.21 110.95 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.18 135.74 46.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.912 0.387 . . . . 74.23 110.318 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.631 HG12 ' HG2' ' A' ' 29' ' ' ARG . 39.1 mt -111.48 157.75 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.158 0.504 . . . . 73.13 111.564 -173.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' HG23 ' A' ' 41' ' ' ILE . 98.5 mttt -97.32 -55.1 2.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.073 0.463 . . . . 72.32 110.387 171.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -143.9 155.35 44.05 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.989 -0.55 . . . . 74.43 111.348 175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.419 ' O ' HG12 ' A' ' 61' ' ' ILE . 39.7 ttm180 -115.99 110.65 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.985 0.421 . . . . 74.21 110.241 175.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 90.9 m -94.98 125.55 39.72 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.292 0.479 . . . . 73.34 112.292 -175.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -108.06 158.08 17.71 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.26 0.553 . . . . 74.12 112.371 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -96.55 107.21 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.539 -0.755 . . . . 75.42 110.659 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.75 HD11 HG21 ' A' ' 59' ' ' VAL . 56.6 mt -120.43 160.56 22.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.204 0.526 . . . . 65.21 111.433 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HZ2' ' HB3' ' A' ' 56' ' ' MET . 29.8 mmmt -115.45 145.6 42.43 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.235 -0.438 . . . . 75.13 110.871 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.1 m -128.73 123.66 33.6 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 122.216 -0.303 . . . . 74.12 111.759 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -64.36 -31.72 73.04 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.618 0.599 . . . . 72.2 112.618 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.488 ' HA3' ' O ' ' A' ' 15' ' ' THR . . . -50.32 -75.67 0.2 Allowed Glycine 0 CA--C 1.525 0.661 0 C-N-CA 121.09 -0.576 . . . . 72.55 113.406 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -86.74 7.42 26.86 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 122.455 -0.438 . . . . 74.34 111.63 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 55.43 36.78 64.29 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 114.486 0.554 . . . . 74.14 114.486 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -133.28 -179.72 5.68 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.071 0.462 . . . . 74.1 111.407 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.511 ' HB3' ' HZ2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -89.87 149.19 22.75 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.115 0.483 . . . . 75.33 111.134 176.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.562 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 31.2 pt -124.46 136.3 61.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 73.31 110.668 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.722 ' HA ' HE21 ' A' ' 58' ' ' GLN . 0.0 OUTLIER -94.58 104.41 16.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.428 -0.509 . . . . 65.31 110.461 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.75 HG21 HD11 ' A' ' 48' ' ' LEU . 95.6 t -95.01 117.05 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.937 0.347 . . . . 74.24 111.937 -174.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.7 m -106.97 116.55 32.11 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.381 -0.372 . . . . 62.42 111.191 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.452 HG22 HG13 ' A' ' 105' ' ' ILE . 21.8 pt -110.16 148.9 39.29 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.186 -0.461 . . . . 73.33 111.126 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.34 153.85 56.98 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.517 2.145 . . . . 72.32 113.195 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.42 -19.19 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.55 0.574 . . . . 62.2 112.55 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.8 m -68.35 -9.33 47.3 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.686 0.279 . . . . 70.54 111.689 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.451 HG13 HD13 ' A' ' 61' ' ' ILE . 45.5 t -92.8 132.14 31.96 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 116.481 -0.327 . . . . 65.21 111.501 179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -177.09 1.9 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.594 2.196 . . . . 73.42 113.778 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.462 ' HG ' ' HG2' ' A' ' 69' ' ' GLU . 30.9 tp -82.67 141.68 32.27 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.088 -0.506 . . . . 75.11 111.806 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -102.4 -68.2 0.84 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.858 0.361 . . . . 75.24 111.643 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.462 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 38.1 mm-40 50.75 56.12 8.48 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.668 0.618 . . . . 75.42 112.668 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -75.73 171.49 14.27 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.0 0.429 . . . . 74.44 111.189 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -71.52 151.46 43.87 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 75.1 112.305 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 82.0 t80 -56.98 121.85 10.91 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.726 -0.67 . . . . 65.02 110.798 174.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.691 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.9 OUTLIER 72.09 30.39 2.16 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.678 0.622 . . . . 74.12 112.678 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -84.25 145.1 28.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.535 -0.302 . . . . 62.11 110.512 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -74.46 114.99 13.48 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.165 -0.335 . . . . 72.13 111.458 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.49 HG13 HD22 ' A' ' 107' ' ' LEU . 31.0 m -125.5 147.24 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 120.671 0.272 . . . . 72.45 111.599 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.38 149.59 50.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.876 0.369 . . . . 75.45 110.789 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.407 ' CD2' HG12 ' A' ' 105' ' ' ILE . 98.1 mt -102.16 137.18 40.76 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.591 0.589 . . . . 73.22 112.591 -172.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.8 mm -83.68 106.67 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.909 -0.587 . . . . 71.35 110.515 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.431 ' N ' HD21 ' A' ' 80' ' ' ASN . 0.9 OUTLIER 62.09 64.35 1.86 Allowed Pre-proline 0 N--CA 1.476 0.862 0 CA-C-N 116.268 -0.424 . . . . 72.4 112.138 -178.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.98 128.86 6.7 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.62 2.214 . . . . 65.31 112.979 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.6 pt -135.06 127.48 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.962 0.41 . . . . 75.31 111.565 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.12 99.69 3.44 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.875 -0.417 . . . . 75.02 109.875 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.36 159.65 32.76 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.298 0.57 . . . . 73.11 112.24 -171.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.1 m -136.17 -10.72 1.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.907 -0.588 . . . . 73.32 111.92 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.7 m -116.06 2.77 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 N-CA-C 112.621 0.6 . . . . 73.22 112.621 -174.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.423 ' O ' HG22 ' A' ' 90' ' ' THR . . . -63.55 78.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.103 0.478 . . . . 72.44 111.985 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.7 p -59.46 -25.9 64.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.301 -0.409 . . . . 74.53 111.936 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.77 58.88 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.505 0.557 . . . . 74.32 112.505 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.488 ' OG1' ' HB3' ' A' ' 95' ' ' ASP . 11.5 t -93.73 -40.62 10.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 120.903 0.382 . . . . 74.32 111.775 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -65.81 -31.48 72.47 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.794 0.331 . . . . 75.2 111.644 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -62.5 -25.97 68.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.007 0.432 . . . . 65.24 110.759 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -97.72 13.85 63.55 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 116.091 -0.504 . . . . 73.33 112.929 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 61.45 25.45 15.39 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.41 0.522 . . . . 73.14 112.41 179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.488 ' HB3' ' OG1' ' A' ' 90' ' ' THR . 9.9 t70 -97.81 114.28 26.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.015 0.436 . . . . 73.02 110.172 178.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 16.3 t -104.88 -6.73 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.058 0.762 . . . . 73.23 113.058 -169.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -62.44 121.98 14.59 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.019 0.437 . . . . 53.01 110.632 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.562 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -59.75 123.3 16.51 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 113.998 1.11 . . . . 74.22 113.998 -171.506 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.404 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 70.6 m-85 -97.2 117.37 31.26 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.552 -1.204 . . . . 72.1 111.026 175.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 28.6 mt -95.92 105.47 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 121.18 0.514 . . . . 74.12 110.194 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -78.66 136.16 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.171 -0.468 . . . . 73.23 111.306 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.38 155.53 47.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.387 -0.37 . . . . 74.44 110.657 179.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -80.82 -23.64 39.06 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.55 0.214 . . . . 75.5 111.333 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -169.89 159.54 7.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.276 0.56 . . . . 63.0 111.741 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.452 HG13 HG22 ' A' ' 61' ' ' ILE . 37.0 mt -119.57 109.07 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.844 -0.616 . . . . 74.22 111.223 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.0 m -113.16 178.63 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 120.834 0.35 . . . . 72.35 111.084 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.49 HD22 HG13 ' A' ' 76' ' ' VAL . 96.1 mt -88.04 151.33 22.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.19 0.519 . . . . 75.21 111.331 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.526 HG21 ' HG ' ' A' ' 109' ' ' LEU . 16.8 m -87.03 134.9 33.45 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 110.138 -0.319 . . . . 73.53 110.138 176.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.526 ' HG ' HG21 ' A' ' 108' ' ' THR . 81.9 mt 65.75 20.59 11.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.274 0.472 . . . . 70.32 112.274 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.474 ' HB3' ' HB2' ' A' ' 107' ' ' LEU . 7.0 pt-20 . . . . . 0 C--O 1.251 1.173 0 N-CA-C 112.315 0.487 . . . . 74.52 112.315 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.7 ttm . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.668 0.27 . . . . 73.31 111.244 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.43 ' O ' ' HB2' ' A' ' 6' ' ' ASN . 64.0 mtt -131.5 136.22 47.72 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.619 0.247 . . . . 62.01 110.735 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -59.75 -14.56 14.99 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.019 0.438 . . . . 74.11 111.133 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.403 ' N ' HD21 ' A' ' 4' ' ' LEU . 2.9 mm? -69.73 114.89 8.36 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.073 -0.512 . . . . 75.51 110.541 174.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 74.96 -42.04 0.48 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.902 0.705 . . . . 73.44 112.902 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 2' ' ' MET . 14.1 m120 -75.86 90.67 2.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.012 0.434 . . . . 64.44 111.706 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -129.47 -55.15 0.1 Allowed Glycine 0 CA--C 1.527 0.784 0 C-N-CA 121.478 -0.391 . . . . 63.51 112.76 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.7 pt -59.96 149.15 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 120.836 0.35 . . . . 74.35 111.925 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.8 t -70.1 130.43 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 120.824 0.345 . . . . 64.43 111.346 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.36 178.56 7.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.154 0.502 . . . . 74.43 112.142 -176.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -66.22 171.41 4.75 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.898 -0.592 . . . . 74.24 112.596 -177.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.755 ' HB2' ' HZ2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -174.45 142.69 0.78 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.169 -0.468 . . . . 73.54 110.943 174.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -66.9 105.15 1.53 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.957 0.408 . . . . 61.11 111.72 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.6 p -74.82 82.24 2.13 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.312 0.577 . . . . 74.3 111.101 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -98.67 131.56 44.74 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.083 -0.508 . . . . 62.11 111.487 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.412 ' HB3' HD23 ' A' ' 19' ' ' LEU . 98.5 m-85 -70.55 -50.14 40.57 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.279 -0.419 . . . . 73.22 111.752 -177.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.71 -159.14 32.89 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.002 -0.545 . . . . 70.31 112.075 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.568 ' HG2' ' HG2' ' A' ' 51' ' ' LYS . 10.4 pt-20 -66.84 109.03 2.75 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.291 0.567 . . . . 72.01 110.809 175.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.454 ' HB2' HG23 ' A' ' 76' ' ' VAL . 99.1 mt -73.72 127.43 32.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 62.02 110.57 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HB3' ' HZ3' ' A' ' 20' ' ' LYS . 8.1 mtpm? -101.85 105.64 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.189 0.519 . . . . 74.2 111.298 -175.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -58.6 135.49 57.37 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.409 -0.814 . . . . 73.35 112.651 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.6 m -113.17 -62.47 1.58 Allowed 'General case' 0 N--CA 1.471 0.615 0 O-C-N 122.039 -0.413 . . . . 74.3 111.529 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.9 163.17 40.49 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.299 0.571 . . . . 74.14 112.104 -178.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 51.4 tp -74.81 111.8 10.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.319 -0.622 . . . . 74.54 109.319 171.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.49 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 13.4 tpt180 -63.54 -50.03 71.13 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.666 -0.243 . . . . 73.31 111.651 -172.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -176.74 147.58 0.63 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.531 0.567 . . . . 75.34 112.531 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 43.6 mt-10 -105.93 102.38 11.82 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.972 -0.558 . . . . 74.52 110.419 171.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -81.54 113.12 20.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 121.495 0.664 . . . . 73.33 110.267 174.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -101.1 157.1 17.02 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.138 -0.483 . . . . 72.13 110.681 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.2 mt -67.42 108.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.238 0.542 . . . . 71.42 111.741 -175.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -88.94 119.48 29.5 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.364 -0.38 . . . . 71.41 110.925 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.67 158.32 32.49 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.199 0.444 . . . . 74.2 112.199 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.37 -17.31 28.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.374 -0.375 . . . . 72.24 111.558 174.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.34 -4.79 35.53 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.327 -0.397 . . . . 64.11 111.851 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -28.66 10.3 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.318 -0.467 . . . . 42.54 113.181 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.2 m -81.98 153.64 26.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.057 0.456 . . . . 71.11 111.901 -178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.17 133.79 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.133 0.492 . . . . 75.44 111.404 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -84.03 167.33 16.96 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.334 0.588 . . . . 74.04 112.225 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.65 -25.07 64.63 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.758 -0.655 . . . . 72.11 110.72 176.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -76.4 131.33 39.05 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.848 -0.614 . . . . 73.24 111.623 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -94.72 149.0 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.417 -0.356 . . . . 71.43 110.765 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -92.92 -57.36 2.67 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.65 0.262 . . . . 75.31 111.23 -177.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.445 ' OE1' ' HE3' ' A' ' 101' ' ' LYS . 14.7 pt-20 -163.82 168.66 19.3 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.748 0.309 . . . . 72.4 111.22 176.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.51 ' HD3' HD11 ' A' ' 67' ' ' LEU . 45.6 mtt180 -128.18 125.63 39.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.565 0.579 . . . . 75.44 112.565 -174.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 28.9 m -100.05 133.29 44.66 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 116.035 -0.529 . . . . 71.22 112.091 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.59 151.6 35.88 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.076 0.55 . . . . 72.22 112.39 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.49 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 31.8 m-20 -91.24 107.62 19.33 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.048 -0.524 . . . . 71.43 111.276 171.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 59' ' ' VAL . 77.0 mt -116.08 120.72 39.98 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.919 0.39 . . . . 73.4 110.724 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.726 ' NZ ' ' SD ' ' A' ' 56' ' ' MET . 71.7 mmtt -92.7 148.34 22.13 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.41 -0.359 . . . . 74.24 110.853 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.8 m -72.34 158.68 35.35 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.718 0.294 . . . . 55.15 111.568 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.568 ' HG2' ' HG2' ' A' ' 18' ' ' GLU . 1.9 tmtp? -58.0 -63.67 1.17 Allowed 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 116.569 -0.287 . . . . 74.22 111.578 -177.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.95 47.11 0.54 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.102 -0.57 . . . . 71.53 113.195 -177.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -110.2 -32.2 7.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.959 0.409 . . . . 64.25 111.117 178.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.97 27.96 8.02 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 121.223 -0.513 . . . . 74.12 113.453 -178.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -139.9 178.11 7.49 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.658 -0.319 . . . . 75.21 110.72 178.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.726 ' SD ' ' NZ ' ' A' ' 49' ' ' LYS . 21.4 ptt? -145.7 168.8 19.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.926 0.393 . . . . 65.12 111.664 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.56 134.52 46.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.009 -0.541 . . . . 73.15 110.749 176.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.37 105.37 17.45 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.905 0.383 . . . . 73.22 110.506 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 67.5 t -97.33 120.17 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 120.944 0.402 . . . . 74.35 111.927 -173.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 15.4 t -109.47 115.1 29.3 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.911 0.386 . . . . 61.02 111.61 -178.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -103.6 151.57 38.74 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 116.512 -0.313 . . . . 64.13 111.676 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.47 148.6 90.25 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.71 2.273 . . . . 73.11 113.303 -178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -15.07 63.45 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.725 0.639 . . . . 63.41 112.725 -177.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 43.9 t -64.02 -20.58 66.01 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.981 0.42 . . . . 73.2 111.114 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.0 t -92.84 122.69 63.37 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.188 -0.46 . . . . 74.42 111.207 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.09 151.45 16.59 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.97 2.447 . . . . 71.54 113.637 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.51 HD11 ' HD3' ' A' ' 44' ' ' ARG . 28.7 tp -69.73 141.35 53.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.277 -0.419 . . . . 71.25 111.576 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -81.4 -57.63 3.4 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.028 0.751 . . . . 73.31 113.028 -170.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 59.5 41.86 18.51 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.263 0.468 . . . . 71.34 112.263 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.54 168.22 7.74 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.209 0.528 . . . . 75.14 111.651 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.89 153.35 43.39 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.495 -0.32 . . . . 74.42 110.911 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.431 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 59.0 t80 -62.64 119.05 8.49 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.795 0.331 . . . . 72.34 111.335 -178.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 0.9 OUTLIER 71.54 19.8 5.0 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.246 0.618 . . . . 72.22 112.1 -178.159 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.77 141.21 58.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.088 0.47 . . . . 71.15 110.891 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -72.94 112.65 9.17 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.932 -0.577 . . . . 74.43 111.128 -177.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.511 HG11 HD23 ' A' ' 107' ' ' LEU . 32.4 m -126.45 161.47 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.201 0.524 . . . . 71.34 111.891 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 108' ' ' THR . 11.9 pt-20 -143.02 154.26 43.81 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.014 0.435 . . . . 71.11 110.843 176.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.7 mt -95.3 142.66 27.44 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.527 0.565 . . . . 74.51 112.527 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.61 -77.58 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 CA-C-N 116.067 -0.515 . . . . 73.42 110.906 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -130.78 92.23 34.87 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.744 0.306 . . . . 72.41 111.173 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -82.68 156.94 16.11 Favored 'Trans proline' 0 CA--C 1.546 1.095 0 C-N-CA 123.246 2.631 . . . . 72.4 114.25 177.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 pt -145.46 132.87 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.332 0.653 . . . . 74.52 110.558 173.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.04 116.0 15.29 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.12 -0.363 . . . . 53.44 110.857 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.421 ' OD2' HG23 ' A' ' 85' ' ' THR . 18.7 t70 -107.69 -76.98 0.6 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.902 0.382 . . . . 73.52 111.733 -174.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.421 HG23 ' OD2' ' A' ' 84' ' ' ASP . 30.1 p -103.34 85.88 2.56 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.491 0.662 . . . . 74.31 110.922 -178.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.422 HG11 ' O ' ' A' ' 86' ' ' VAL . 8.0 p -74.33 98.38 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 121.971 0.891 . . . . 64.25 110.091 176.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.469 ' HA ' HG21 ' A' ' 90' ' ' THR . . . -53.57 -32.58 51.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.409 -0.814 . . . . 72.12 113.066 -171.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.9 p -56.24 -29.12 60.61 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.291 0.478 . . . . 72.14 112.291 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.58 8.81 35.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.937 0.717 . . . . 52.41 112.937 -176.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.469 HG21 ' HA ' ' A' ' 87' ' ' ALA . 7.4 t -114.4 2.13 14.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 121.926 -0.484 . . . . 71.02 112.203 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -114.19 -173.66 2.33 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.061 0.457 . . . . 71.43 112.075 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -93.64 28.73 2.22 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.47 0.545 . . . . 74.02 112.47 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 128.12 -21.28 5.53 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 120.813 -0.708 . . . . 44.14 113.911 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.98 111.95 3.09 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.868 0.692 . . . . 75.21 112.868 -177.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -80.88 108.77 14.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.317 -0.402 . . . . 63.31 110.507 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -135.64 -179.31 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 121.185 0.517 . . . . 73.41 112.102 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.18 155.53 13.93 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.66 0.615 . . . . 64.04 112.66 178.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -123.14 158.87 29.77 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.274 0.559 . . . . 73.14 112.33 -172.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -111.05 126.09 54.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 121.634 0.73 . . . . 74.42 112.737 -172.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 63.6 mt -116.51 125.1 73.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.557 -0.747 . . . . 75.41 110.937 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.445 ' HE3' ' OE1' ' A' ' 43' ' ' GLU . 56.6 mtpt -90.39 143.14 27.04 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.723 -0.473 . . . . 75.44 109.723 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.95 164.0 29.38 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.054 0.761 . . . . 70.03 113.054 -174.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.3 -58.75 5.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.235 -0.893 . . . . 75.33 110.914 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -164.37 163.25 22.45 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.205 -0.452 . . . . 75.21 111.492 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 50.2 mt -120.02 124.76 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.083 -0.508 . . . . 74.2 111.189 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.2 m -123.34 179.29 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 122.282 -0.261 . . . . 74.33 111.291 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.511 HD23 HG11 ' A' ' 76' ' ' VAL . 93.0 mt -81.04 151.76 28.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.856 0.36 . . . . 75.14 111.311 178.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.408 ' HA ' ' OE1' ' A' ' 77' ' ' GLU . 24.7 m -72.96 129.5 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.898 0.38 . . . . 74.14 111.955 -179.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.57 -54.23 11.16 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.098 0.475 . . . . 75.03 111.732 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 . . . . . 0 C--O 1.253 1.269 0 CA-C-N 115.996 -0.547 . . . . 74.2 112.203 -178.987 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 mmt . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.778 0.323 . . . . 71.33 111.455 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 62.2 mtt 59.31 67.78 0.87 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.403 0.621 . . . . 71.44 111.846 -178.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -84.2 106.74 16.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.85 -0.614 . . . . 70.14 110.637 175.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.91 137.37 57.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.941 0.4 . . . . 74.55 111.562 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.42 123.62 26.27 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.112 0.482 . . . . 72.55 111.923 -179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -113.71 -176.36 2.88 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.981 -0.554 . . . . 71.33 111.227 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 159.69 -65.57 0.28 Allowed Glycine 0 CA--C 1.529 0.908 0 C-N-CA 120.889 -0.672 . . . . 55.1 113.116 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.8 pt -118.53 174.88 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 O-C-N 122.564 -0.374 . . . . 74.02 111.573 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -57.08 112.4 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-O 121.384 0.612 . . . . 63.52 111.675 176.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.4 HD11 ' N ' ' A' ' 11' ' ' ASP . 4.0 pp -60.75 -22.42 64.01 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.417 0.525 . . . . 74.34 112.417 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.4 ' N ' HD11 ' A' ' 10' ' ' LEU . 2.6 m-20 -59.23 -27.84 66.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.847 0.356 . . . . 64.1 111.755 176.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -100.45 -14.96 18.08 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.018 0.437 . . . . 74.13 111.242 176.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -72.06 -38.77 69.4 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.451 -0.34 . . . . 70.4 111.121 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -83.08 135.1 34.95 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 121.099 0.476 . . . . 60.35 111.565 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.3 p -125.08 -168.81 1.88 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.169 0.509 . . . . 75.03 111.895 -177.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.575 ' HD1' ' HG ' ' A' ' 50' ' ' SER . 71.1 m-85 -88.83 95.88 10.47 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 122.048 -0.408 . . . . 74.34 112.097 -176.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -73.0 -99.69 0.08 OUTLIER Glycine 0 CA--C 1.531 1.047 0 C-N-CA 121.108 -0.568 . . . . 70.14 112.504 174.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.44 ' HB2' ' HB3' ' A' ' 51' ' ' LYS . 45.2 mt-10 -76.54 120.89 22.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.488 -0.419 . . . . 72.44 111.741 174.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.455 HD21 ' HB3' ' A' ' 16' ' ' PHE . 95.5 mt -113.6 114.9 27.1 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.588 -0.523 . . . . 75.44 109.588 171.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -125.71 129.37 49.4 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.49 0.662 . . . . 73.41 112.665 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -67.66 138.12 56.09 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.313 -0.858 . . . . 74.51 112.348 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.446 ' OG ' ' HD3' ' A' ' 49' ' ' LYS . 59.1 m -113.47 -64.7 1.27 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 111.893 0.331 . . . . 70.22 111.893 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.43 168.97 24.0 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.293 0.568 . . . . 74.41 112.393 -177.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 64.8 tp -81.41 112.09 18.36 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.57 -0.741 . . . . 72.5 110.278 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -68.51 -52.64 29.94 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.81 0.338 . . . . 73.21 111.34 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -175.56 134.84 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.058 0.392 . . . . 75.12 112.058 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.539 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.3 mt-10 -93.16 98.41 11.28 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.895 -0.409 . . . . 73.45 109.895 169.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.5 m -70.41 128.08 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.968 0.414 . . . . 72.04 110.752 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 41' ' ' ILE . 62.6 mtt180 -100.96 168.6 9.51 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.564 0.697 . . . . 75.41 112.804 -175.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.92 112.43 10.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.312 -0.858 . . . . 72.14 111.116 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.5 tt0 -84.96 115.0 22.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.861 0.362 . . . . 74.41 111.081 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -55.76 144.9 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.217 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -55.49 -24.01 29.09 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.365 0.505 . . . . 74.21 112.365 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.76 -37.9 74.45 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.007 0.432 . . . . 74.4 111.552 173.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.52 -17.24 5.57 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.35 -0.453 . . . . 53.31 113.098 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.4 m -94.77 148.83 21.88 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.31 -0.523 . . . . 74.33 111.754 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 34.1 t -82.38 143.62 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 120.949 0.404 . . . . 74.32 111.794 -177.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -94.02 178.84 5.52 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.037 0.446 . . . . 52.14 111.771 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -85.07 -21.42 29.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.3 -0.409 . . . . 74.24 111.29 177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -69.74 136.63 51.18 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.474 -0.33 . . . . 74.35 110.805 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.473 ' HA ' ' HG2' ' A' ' 29' ' ' ARG . 50.7 mt -90.39 144.73 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.339 0.59 . . . . 74.23 111.858 -175.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.489 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 28.9 tptp -97.9 -59.18 1.82 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.626 -0.715 . . . . 63.03 110.904 179.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.489 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.9 mt-10 -145.92 170.21 17.05 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.993 0.425 . . . . 75.42 111.089 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.539 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 54.5 mtt180 -128.1 119.05 24.55 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.778 0.431 . . . . 74.54 111.367 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 62.9 m -100.99 131.42 46.88 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.27 0.47 . . . . 72.34 112.27 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.546 ' HH ' HD11 ' A' ' 61' ' ' ILE . 39.6 m-85 -125.08 156.33 38.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.719 0.407 . . . . 74.24 111.38 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -99.97 123.04 43.78 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.693 -0.23 . . . . 71.34 111.413 173.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.412 HD12 HG21 ' A' ' 59' ' ' VAL . 51.6 mt -119.72 130.21 54.89 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.805 0.336 . . . . 75.43 111.498 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HE3' ' SD ' ' A' ' 56' ' ' MET . 14.3 mptt -80.83 115.54 20.37 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.624 0.249 . . . . 75.35 110.834 173.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.575 ' HG ' ' HD1' ' A' ' 16' ' ' PHE . 46.6 t -101.26 108.75 20.47 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.679 0.276 . . . . 74.33 111.187 177.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.44 ' HB3' ' HB2' ' A' ' 18' ' ' GLU . 17.5 tppt? -69.38 -38.24 77.94 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.877 0.37 . . . . 74.43 111.485 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.69 -39.32 93.67 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 121.037 -0.601 . . . . 74.43 113.074 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.41 ' HG2' ' HZ2' ' A' ' 98' ' ' TRP . 6.2 tp-100 -88.12 -21.63 24.56 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.981 0.42 . . . . 74.2 111.539 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.91 26.84 73.87 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 121.421 -0.419 . . . . 63.54 112.853 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -135.56 158.38 44.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.982 0.42 . . . . 75.24 111.708 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.511 ' SD ' ' HE3' ' A' ' 49' ' ' LYS . 63.8 mtm -93.56 107.73 19.55 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.638 -0.505 . . . . 71.41 109.638 168.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.451 HD11 HD13 ' A' ' 100' ' ' ILE . 24.2 pt -94.71 134.83 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.465 0.174 . . . . 72.34 111.393 -174.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -90.6 104.94 17.46 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 75.4 111.204 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 91.9 t -96.59 128.37 47.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.91 -0.587 . . . . 75.12 111.31 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.587 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 48.9 m -123.08 137.82 54.83 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 65.02 111.891 -176.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.546 HD11 ' HH ' ' A' ' 46' ' ' TYR . 26.4 pt -124.42 147.81 56.43 Favored Pre-proline 0 N--CA 1.472 0.671 0 CA-C-N 116.213 -0.449 . . . . 74.33 110.798 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.36 150.54 86.82 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.298 1.999 . . . . 74.53 112.482 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.13 -32.94 37.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.763 0.653 . . . . 75.3 112.763 -176.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.8 m -53.46 -32.81 51.69 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.233 0.457 . . . . 71.42 112.233 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -82.08 116.15 61.73 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.616 -0.265 . . . . 72.44 110.748 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -49.74 141.43 27.67 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.163 2.575 . . . . 73.41 113.755 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.545 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 31.6 tp -52.63 138.0 29.44 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.302 -0.408 . . . . 72.04 110.844 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.509 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 24.7 mmmt -79.97 -57.55 3.59 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.621 0.6 . . . . 74.24 112.621 -170.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.545 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 39.2 mt-10 57.86 39.57 26.74 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 112.592 0.59 . . . . 64.13 112.592 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -70.66 172.69 8.23 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.168 0.508 . . . . 74.31 112.056 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.531 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 5.8 m-20 -70.17 157.72 37.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.381 0.61 . . . . 65.22 112.084 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.435 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 7.6 t80 -70.66 117.38 12.11 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.793 -0.639 . . . . 72.35 110.902 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 46.9 m-80 74.92 21.82 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.592 0.757 . . . . 64.44 112.069 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.531 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -74.95 141.63 44.04 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.963 0.357 . . . . 63.14 111.963 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.473 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 70.7 mtm180 -67.45 116.16 7.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.599 -0.273 . . . . 71.01 110.717 178.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.52 140.03 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-O 121.042 0.449 . . . . 75.41 112.171 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -124.53 157.16 35.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.232 0.539 . . . . 70.11 111.025 178.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.95 132.13 45.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.262 -0.427 . . . . 72.0 111.777 -176.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.576 HG21 ' ND2' ' A' ' 80' ' ' ASN . 50.0 mm -63.62 -72.61 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 116.28 -0.418 . . . . 75.11 111.364 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.576 ' ND2' HG21 ' A' ' 79' ' ' ILE . 41.0 m-80 -125.32 89.96 51.64 Favored Pre-proline 0 N--CA 1.476 0.858 0 CA-C-O 120.573 0.225 . . . . 74.13 110.452 174.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.87 147.7 15.24 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.202 2.601 . . . . 64.45 114.352 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 101' ' ' LYS . 38.4 pt -140.04 149.14 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.967 0.413 . . . . 73.15 110.78 172.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.14 116.51 28.87 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.916 0.388 . . . . 70.25 110.816 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.525 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . 17.9 t70 -83.67 158.38 21.86 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.479 0.657 . . . . 74.12 112.442 -174.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.4 m -139.26 -8.72 1.3 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.854 -0.612 . . . . 70.41 111.462 176.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.427 HG21 HG21 ' A' ' 90' ' ' THR . 9.8 p -86.6 -10.71 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.938 -0.476 . . . . 72.4 111.382 -176.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.75 -13.53 10.58 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.476 0.547 . . . . 62.52 112.476 178.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.0 t -109.91 -9.93 14.76 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.024 0.44 . . . . 73.52 111.535 174.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -91.62 -57.2 2.84 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.336 -0.393 . . . . 74.21 111.816 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.427 HG21 HG21 ' A' ' 86' ' ' VAL . 9.8 t -85.93 -23.03 27.14 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.994 0.426 . . . . 73.42 111.274 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -113.67 104.77 12.57 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.248 -0.433 . . . . 74.32 109.859 174.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -79.55 107.9 12.67 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 73.42 111.975 -172.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.37 12.43 67.43 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 121.459 -0.4 . . . . 64.12 113.642 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.15 -31.89 23.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 122.385 -0.479 . . . . 72.4 112.21 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.479 ' HA ' ' HE1' ' A' ' 99' ' ' TYR . 33.5 t70 -68.69 141.92 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.891 0.377 . . . . 63.4 111.751 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.62 -78.62 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 120.888 0.375 . . . . 65.43 110.751 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.95 -61.22 1.61 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.584 -0.28 . . . . 70.14 110.812 174.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.41 ' HZ2' ' HG2' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -172.37 143.02 1.37 Allowed 'General case' 0 C--O 1.247 0.965 0 CA-C-O 122.545 1.164 . . . . 73.45 113.982 170.388 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.479 ' HE1' ' HA ' ' A' ' 95' ' ' ASP . 53.5 m-85 -110.39 122.27 47.28 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.25 -1.341 . . . . 75.34 111.094 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 34.6 mt -105.27 104.63 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.085 0.469 . . . . 73.44 110.46 177.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.587 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 50.3 mtpt -87.42 130.26 34.73 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.997 -0.44 . . . . 75.22 111.17 -176.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.12 157.93 31.81 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.651 0.611 . . . . 50.55 112.651 -173.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.454 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 28.9 t70 -66.95 -38.37 86.01 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.469 -0.787 . . . . 75.43 111.294 175.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -169.8 161.08 8.98 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.168 -0.469 . . . . 72.54 110.951 176.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.509 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 42.3 mt -119.28 120.98 65.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.148 -0.478 . . . . 65.4 110.883 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.8 m -120.42 -179.65 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 122.218 -0.301 . . . . 74.05 111.105 178.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.5 128.47 35.23 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.944 0.402 . . . . 74.41 111.901 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 26.4 m -64.48 105.93 1.04 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.429 0.633 . . . . 74.43 111.234 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.49 ' H ' HD22 ' A' ' 109' ' ' LEU . 1.8 pt? -74.29 -8.45 56.29 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.514 -0.766 . . . . 75.32 111.91 177.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 . . . . . 0 C--O 1.257 1.479 0 CA-C-O 119.033 -0.508 . . . . 71.53 111.635 -179.704 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 112.008 0.373 . . . . 72.34 112.008 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.471 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.3 OUTLIER -129.83 124.7 33.94 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.845 0.355 . . . . 74.22 110.926 177.095 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -75.31 81.33 2.4 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.222 0.534 . . . . 74.12 111.895 -175.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -105.79 -69.39 0.82 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.099 -0.501 . . . . 74.42 110.792 174.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -111.1 130.92 55.47 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.237 -0.438 . . . . 74.33 111.076 176.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -66.98 123.34 19.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.003 0.43 . . . . 75.33 111.873 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -177.41 131.03 1.72 Allowed Glycine 0 CA--C 1.524 0.645 0 C-N-CA 121.138 -0.553 . . . . 73.12 112.584 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 pt -130.54 153.44 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 121.012 0.434 . . . . 75.34 111.643 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.75 118.91 21.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.98 0.419 . . . . 74.41 111.234 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -84.61 166.78 16.84 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.415 0.626 . . . . 75.45 112.315 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.417 ' OD2' ' HB ' ' A' ' 14' ' ' THR . 5.7 p-10 -79.33 175.03 10.98 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.439 -0.8 . . . . 74.1 112.682 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -118.06 -43.23 2.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.855 -0.612 . . . . 74.04 111.224 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.78 45.4 1.15 Allowed 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.252 0.464 . . . . 72.24 112.252 -175.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.417 ' HB ' ' OD2' ' A' ' 11' ' ' ASP . 6.0 t -65.5 -36.29 83.41 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.583 0.586 . . . . 74.02 112.583 -179.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.4 p -80.69 68.99 7.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.037 0.446 . . . . 73.11 111.741 -177.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.491 ' HE1' HH11 ' A' ' 55' ' ' ARG . 97.5 m-85 -62.65 -50.54 70.8 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.019 0.438 . . . . 73.31 111.56 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 114.25 -107.62 1.88 Allowed Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.291 -0.48 . . . . 72.14 113.009 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -79.02 109.16 13.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.132 0.491 . . . . 73.53 111.338 178.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 50' ' ' SER . 97.2 mt -120.92 117.47 27.41 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.97 -0.559 . . . . 74.24 111.222 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -102.62 139.06 38.7 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.987 0.423 . . . . 74.32 111.21 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.592 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 67.5 t80 -71.98 102.06 2.85 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.275 -0.421 . . . . 73.21 110.581 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.532 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.3 t -73.29 -64.83 0.9 Allowed 'General case' 0 N--CA 1.472 0.625 0 O-C-N 122.018 -0.426 . . . . 71.01 111.864 -175.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.57 171.67 17.65 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.608 0.596 . . . . 75.43 112.608 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.439 HD12 ' CE2' ' A' ' 46' ' ' TYR . 37.1 tp -90.06 105.83 18.07 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.853 -0.612 . . . . 74.13 109.486 169.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -65.82 -53.14 43.96 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.487 -0.324 . . . . 75.41 111.546 -175.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -177.01 141.21 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.247 0.462 . . . . 75.05 112.247 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.41 98.89 11.51 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.647 -0.501 . . . . 71.02 109.647 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.408 HG21 ' HB3' ' A' ' 42' ' ' LYS . 31.9 m -78.16 144.78 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-O 121.303 0.573 . . . . 74.5 111.773 -174.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm180 -109.56 168.35 9.46 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.949 -0.569 . . . . 71.32 112.109 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.0 mt -80.99 141.78 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.977 -0.556 . . . . 74.0 111.164 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -95.45 150.74 19.96 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.088 0.471 . . . . 74.33 111.707 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -93.55 155.45 17.3 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.489 -0.323 . . . . 74.42 110.427 174.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -62.19 -21.34 65.02 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.216 0.532 . . . . 74.43 111.344 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.54 -31.89 70.97 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.917 -0.583 . . . . 62.25 111.582 172.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.53 -34.86 4.47 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 116.222 -0.444 . . . . 51.34 112.156 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.7 m -68.14 153.92 42.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.004 0.431 . . . . 74.2 111.319 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -87.28 146.33 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 120.819 0.343 . . . . 73.43 111.5 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.9 t -90.53 172.4 8.73 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.213 0.53 . . . . 74.35 112.208 -179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -81.07 -15.54 55.72 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.998 -0.546 . . . . 63.32 110.628 173.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.08 135.87 56.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.817 -0.629 . . . . 74.3 110.75 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.93 142.96 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-O 120.929 0.395 . . . . 73.34 111.266 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB3' HG21 ' A' ' 28' ' ' VAL . 29.1 tptp -98.31 -58.26 2.01 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.955 0.407 . . . . 64.13 111.267 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -164.4 166.44 20.65 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.089 0.471 . . . . 71.43 111.291 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 60' ' ' SER . 38.3 mtt180 -114.5 114.39 25.73 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.001 0.371 . . . . 75.33 112.001 -173.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.0 m -91.64 126.92 36.89 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.169 -0.469 . . . . 72.41 112.055 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.737 ' HH ' HD11 ' A' ' 67' ' ' LEU . 92.8 m-85 -123.61 151.75 42.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.209 0.604 . . . . 73.21 111.527 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -102.08 119.27 38.53 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.938 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.587 HD12 HG21 ' A' ' 59' ' ' VAL . 39.6 mt -114.55 141.22 48.02 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.987 0.422 . . . . 75.51 111.922 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.532 ' HG2' ' HB2' ' A' ' 22' ' ' SER . 29.0 mmmt -96.21 124.54 40.25 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.0 -0.545 . . . . 73.41 111.121 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.403 ' HA ' HD23 ' A' ' 19' ' ' LEU . 29.1 t -103.39 106.15 16.59 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.894 0.378 . . . . 74.54 111.477 177.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -74.3 140.77 45.14 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.005 0.431 . . . . 75.22 111.244 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 102.94 -62.82 0.45 Allowed Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.803 -0.519 . . . . 74.02 111.803 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -75.4 -22.85 57.12 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.992 0.425 . . . . 74.53 111.032 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.21 28.64 73.84 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 121.376 -0.44 . . . . 45.5 112.625 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.491 HH11 ' HE1' ' A' ' 16' ' ' PHE . 5.6 ptm180 -110.88 150.12 29.63 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.27 0.557 . . . . 72.14 111.448 -174.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.0 OUTLIER -110.16 131.25 55.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.897 -0.592 . . . . 70.23 110.904 175.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.501 HD11 HD11 ' A' ' 100' ' ' ILE . 24.4 pt -115.02 142.99 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 116.523 -0.308 . . . . 71.24 111.359 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.55 HE22 ' HB2' ' A' ' 97' ' ' ASP . 2.2 mp0 -89.99 104.99 17.5 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.82 0.343 . . . . 74.24 110.572 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.587 HG21 HD12 ' A' ' 48' ' ' LEU . 87.2 t -100.6 129.94 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.079 -0.388 . . . . 70.54 111.424 -178.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.488 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 38.2 t -127.7 151.14 49.34 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.336 0.589 . . . . 75.53 112.275 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.9 pt -134.42 141.04 37.56 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 115.861 -0.609 . . . . 72.4 110.609 176.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.41 ' HG2' HG23 ' A' ' 65' ' ' VAL . 15.5 Cg_endo -56.35 152.25 40.25 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.4 2.067 . . . . 74.24 112.936 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.59 -30.12 19.82 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.301 0.852 . . . . 73.3 113.301 -177.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.5 p -67.26 -20.26 65.63 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.412 0.523 . . . . 70.32 112.412 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.41 HG23 ' HG2' ' A' ' 62' ' ' PRO . 53.2 t -84.78 132.27 46.79 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 120.536 0.208 . . . . 64.13 111.37 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.04 158.98 8.14 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.114 2.543 . . . . 74.14 113.818 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.737 HD11 ' HH ' ' A' ' 46' ' ' TYR . 58.5 tp -76.0 129.65 37.2 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.954 -0.566 . . . . 63.21 111.77 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.41 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 0.0 OUTLIER -86.88 123.46 32.04 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.113 0.482 . . . . 75.12 111.366 174.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -116.72 49.28 1.18 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.715 -0.675 . . . . 71.44 111.397 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -84.4 177.01 8.31 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.948 0.722 . . . . 74.35 112.948 -174.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.3 159.25 15.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.553 -0.749 . . . . 71.31 111.624 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.592 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.1 t80 -59.86 -35.35 74.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.298 0.481 . . . . 74.22 112.298 -179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.433 ' ND2' ' HD2' ' A' ' 72' ' ' TYR . 5.5 m120 -93.73 2.65 56.21 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 122.133 -0.355 . . . . 74.02 111.474 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.17 135.04 42.81 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.015 0.436 . . . . 62.23 111.802 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.585 HH11 ' HA ' ' A' ' 110' ' ' GLU . 82.5 mtt180 -79.53 126.42 30.85 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.166 -0.47 . . . . 74.0 110.327 176.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.2 m -129.28 142.45 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.284 0.564 . . . . 72.0 112.516 -178.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.458 ' HB3' ' HG1' ' A' ' 108' ' ' THR . 12.1 pt-20 -131.25 170.53 14.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.928 -0.578 . . . . 64.13 110.773 177.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.422 HD23 HG11 ' A' ' 59' ' ' VAL . 87.4 mt -114.3 133.36 55.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.866 0.365 . . . . 75.31 111.923 -176.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.576 HG23 ' ND2' ' A' ' 80' ' ' ASN . 50.1 mm -64.97 -65.58 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.158 -0.474 . . . . 63.23 111.645 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.576 ' ND2' HG23 ' A' ' 79' ' ' ILE . 56.2 m-80 -129.04 89.24 49.18 Favored Pre-proline 0 N--CA 1.474 0.744 0 O-C-N 122.18 -0.325 . . . . 63.51 110.669 174.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.04 141.7 13.26 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.927 2.418 . . . . 72.32 114.07 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.483 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.5 pt -133.34 129.66 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.982 0.42 . . . . 75.44 110.787 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.86 114.26 8.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.865 0.364 . . . . 62.44 110.825 175.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -76.45 124.73 28.02 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.447 0.641 . . . . 71.42 111.878 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 34.0 p -117.27 30.32 7.38 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.676 -0.693 . . . . 71.31 111.067 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.4 t -112.68 -48.38 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 120.856 0.36 . . . . 74.4 111.509 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.75 -9.71 46.31 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.298 0.481 . . . . 72.25 112.298 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.1 p -63.86 95.96 0.12 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.94 0.4 . . . . 75.24 111.776 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 65.37 15.59 10.1 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.162 0.801 . . . . 41.35 113.162 174.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.4 t -72.34 -24.42 61.29 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.934 0.397 . . . . 75.33 111.695 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -81.12 161.06 24.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.051 0.453 . . . . 74.33 111.833 -176.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.1 pm0 -90.82 16.23 9.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.218 -0.446 . . . . 64.32 111.965 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -177.79 -41.53 0.06 OUTLIER Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.205 -0.522 . . . . 70.31 113.067 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.86 69.05 1.36 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.173 0.511 . . . . 62.24 112.25 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -83.44 97.01 8.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.388 -0.369 . . . . 71.32 110.521 173.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.8 m -124.12 168.3 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.214 0.531 . . . . 74.43 112.356 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.55 ' HB2' HE22 ' A' ' 58' ' ' GLN . 4.6 m-20 -66.35 177.71 1.41 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.668 -0.696 . . . . 75.33 112.517 -178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -72.74 152.28 41.71 Favored 'General case' 0 C--O 1.25 1.111 0 N-CA-C 114.618 1.34 . . . . 71.21 114.618 -167.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 51.6 m-85 -110.95 136.66 49.63 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.766 -1.561 . . . . 75.14 111.34 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.501 HD11 HD11 ' A' ' 57' ' ' ILE . 51.1 mt -114.72 105.5 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.182 0.515 . . . . 74.41 109.62 171.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.488 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 38.0 mtmt -96.19 133.1 40.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.996 0.427 . . . . 74.4 111.09 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.38 158.44 26.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.464 0.649 . . . . 72.14 112.702 -172.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.473 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 19.9 t70 -59.58 -37.48 78.61 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.263 -0.881 . . . . 71.31 110.976 171.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -170.7 152.86 3.88 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.787 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.41 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 68.0 mt -108.93 118.82 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.767 -0.652 . . . . 74.34 110.953 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -127.16 164.69 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 121.038 0.447 . . . . 71.35 112.071 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 90.6 mt -76.81 137.64 39.35 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.39 0.614 . . . . 73.01 112.236 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.458 ' HG1' ' HB3' ' A' ' 77' ' ' GLU . 5.1 m -84.14 167.74 16.46 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.924 -0.58 . . . . 75.01 110.375 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.403 ' N ' HG22 ' A' ' 108' ' ' THR . 91.1 mt -59.14 102.36 0.13 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.132 0.492 . . . . 74.34 111.826 177.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.585 ' HA ' HH11 ' A' ' 75' ' ' ARG . 49.5 mt-10 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 118.577 -0.725 . . . . 74.32 110.983 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.803 0.335 . . . . 72.23 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 42.5 tpp -166.78 141.17 4.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.445 -0.343 . . . . 64.53 110.848 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -101.29 120.87 40.9 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.694 0.283 . . . . 75.31 111.097 177.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.409 HD22 ' N ' ' A' ' 4' ' ' LEU . 2.9 mm? -117.38 -176.76 3.07 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.1 0.476 . . . . 72.52 111.136 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -129.53 83.89 2.17 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.236 0.541 . . . . 70.32 110.968 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -80.51 76.28 7.35 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.33 0.586 . . . . 54.21 110.73 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.79 150.53 22.43 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.91 -0.662 . . . . 74.45 113.02 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 pt -111.19 -176.57 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 120.993 0.425 . . . . 75.52 111.638 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' ' 9' ' ' VAL . 6.4 p -80.35 101.77 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.546 0.688 . . . . 72.32 111.132 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.441 HD22 ' H ' ' A' ' 10' ' ' LEU . 0.2 OUTLIER -70.94 -74.87 0.14 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.316 -0.402 . . . . 74.15 111.152 -179.247 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.406 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 3.1 m-20 -83.65 164.91 19.4 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.027 0.441 . . . . 54.21 111.404 173.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -67.77 136.98 55.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.949 -0.568 . . . . 75.45 111.536 -173.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -61.67 97.6 0.08 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.339 -0.392 . . . . 64.41 110.775 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 p -61.95 107.79 0.92 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.146 0.498 . . . . 74.5 111.44 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.6 127.08 33.87 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.327 0.584 . . . . 73.33 112.355 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -134.58 152.8 52.03 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.337 -0.392 . . . . 72.04 111.158 177.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.94 -109.42 1.88 Allowed Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.265 -0.493 . . . . 70.42 112.2 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -103.9 114.05 28.03 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.475 0.655 . . . . 60.34 111.215 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.4 mt -90.77 122.02 33.15 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 122.091 -0.381 . . . . 75.4 110.055 176.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -102.79 123.31 46.23 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.302 0.573 . . . . 73.51 112.198 -176.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -67.49 143.57 56.12 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.253 -0.885 . . . . 61.5 111.456 -179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -123.53 -62.94 1.27 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.792 0.294 . . . . 72.52 111.792 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.61 164.14 36.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.248 0.547 . . . . 65.34 112.327 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.61 115.04 9.32 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.888 -0.596 . . . . 75.51 110.707 173.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.41 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 8.4 tpt180 -73.04 -59.72 2.57 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.948 0.404 . . . . 74.4 111.493 -176.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -161.92 139.68 8.82 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.043 0.386 . . . . 70.2 112.043 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -99.8 99.96 10.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.396 -0.594 . . . . 73.24 109.396 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.495 HG21 ' HB2' ' A' ' 42' ' ' LYS . 16.0 m -68.19 87.98 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.784 0.802 . . . . 74.01 111.254 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.74 ' HG2' HG12 ' A' ' 41' ' ' ILE . 46.8 mtt180 -82.07 155.91 24.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.884 -0.598 . . . . 74.14 111.825 -176.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.653 HG12 ' HE2' ' A' ' 42' ' ' LYS . 54.2 mt -68.63 107.47 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 115.862 -0.608 . . . . 70.41 111.829 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.45 112.61 20.53 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.034 0.445 . . . . 74.42 110.227 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -60.04 164.72 3.79 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.798 -0.637 . . . . 61.54 112.51 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.2 -32.07 64.05 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.304 0.573 . . . . 72.42 110.911 176.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.24 -8.22 43.89 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.633 -0.712 . . . . 74.32 111.865 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.04 -3.49 82.62 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.231 -0.509 . . . . 73.12 113.027 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.4 p -84.15 155.21 22.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.859 0.361 . . . . 71.21 111.479 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 43.9 t -95.74 124.31 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.885 0.374 . . . . 75.32 111.563 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 t -85.7 152.72 22.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.353 -0.385 . . . . 73.44 111.446 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.85 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.937 0.398 . . . . 64.14 111.029 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.85 143.05 58.2 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.244 0.545 . . . . 71.32 111.806 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.74 HG12 ' HG2' ' A' ' 29' ' ' ARG . 31.1 mt -113.06 145.93 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.672 -175.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.653 ' HE2' HG12 ' A' ' 30' ' ' ILE . 73.9 mmtt -78.76 -50.66 10.99 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.233 0.539 . . . . 71.33 110.176 170.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.84 168.18 8.93 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.732 -0.667 . . . . 74.34 111.404 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.3 mtt180 -114.87 117.19 29.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.694 0.398 . . . . 74.34 112.032 -173.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.1 m -96.32 132.42 41.82 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.338 -0.392 . . . . 74.32 111.788 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.528 ' HH ' HD11 ' A' ' 67' ' ' LEU . 66.9 m-85 -122.97 153.97 39.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.679 0.391 . . . . 70.42 111.659 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.41 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 61.4 m-20 -88.48 113.17 23.78 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.693 0.282 . . . . 64.3 111.664 175.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.588 HD12 HG21 ' A' ' 59' ' ' VAL . 67.5 mt -113.19 122.14 46.6 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.011 0.434 . . . . 75.23 110.865 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -94.5 141.12 28.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.094 0.474 . . . . 74.32 112.076 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB2' ' HG2' ' A' ' 55' ' ' ARG . 19.6 m -108.89 107.7 18.19 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.514 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -58.91 153.41 17.36 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.198 0.523 . . . . 73.44 111.84 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.9 -45.88 3.38 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.246 -0.502 . . . . 74.24 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -85.08 -27.59 26.2 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.893 0.378 . . . . 75.3 111.139 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.38 43.59 94.73 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 121.427 -0.416 . . . . 65.02 113.132 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.429 ' HG2' ' HB2' ' A' ' 50' ' ' SER . 15.8 ptt180 -117.84 148.95 41.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.213 0.53 . . . . 74.51 111.86 -176.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.474 ' N ' ' SD ' ' A' ' 56' ' ' MET . 3.3 mpp? -111.8 108.4 17.79 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.824 -0.625 . . . . 74.11 110.055 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.5 pt -98.1 144.71 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.715 0.293 . . . . 72.0 111.091 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 87.4 mm-40 -97.48 105.05 17.13 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.055 0.455 . . . . 75.42 110.973 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.588 HG21 HD12 ' A' ' 48' ' ' LEU . 98.9 t -107.19 128.31 62.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 116.442 -0.345 . . . . 74.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 31.5 t -126.46 134.72 50.88 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.295 0.48 . . . . 63.33 112.295 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.6 pt -115.13 143.98 31.27 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 116.271 -0.422 . . . . 74.11 111.192 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.65 147.38 60.1 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.585 2.19 . . . . 74.1 113.193 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.03 -16.89 20.75 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.057 0.762 . . . . 75.13 113.057 -176.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 m -74.96 -4.53 38.73 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.025 0.38 . . . . 41.41 112.025 177.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.417 HG11 ' HZ3' ' A' ' 68' ' ' LYS . 48.8 t -102.19 131.43 22.62 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 122.487 0.315 . . . . 74.4 111.201 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.99 146.03 17.91 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.003 2.468 . . . . 75.51 113.869 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.528 HD11 ' HH ' ' A' ' 46' ' ' TYR . 60.0 tp -70.01 136.83 50.81 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.939 -0.573 . . . . 74.42 111.686 -178.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HZ3' HG11 ' A' ' 65' ' ' VAL . 9.5 mptt -87.68 133.2 33.88 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.168 0.508 . . . . 75.42 112.12 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -117.9 30.92 6.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.644 -0.707 . . . . 64.3 111.161 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -64.54 161.39 17.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.637 0.606 . . . . 75.24 112.637 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -83.49 163.58 20.38 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.636 -0.711 . . . . 54.02 112.102 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -64.17 120.92 13.02 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.25 -0.432 . . . . 74.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 66.4 34.3 6.38 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 70.41 111.865 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.58 118.68 20.22 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.471 -0.331 . . . . 71.43 111.198 175.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -60.11 108.87 0.84 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.877 0.37 . . . . 63.43 111.663 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.462 HG13 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.85 169.75 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.407 0.622 . . . . 74.05 111.817 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.87 157.96 44.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.043 -0.526 . . . . 72.23 110.697 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 93.5 mt -102.65 126.55 49.79 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.944 0.35 . . . . 73.53 111.944 -175.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.612 HG23 ' ND2' ' A' ' 80' ' ' ASN . 50.2 mm -56.13 -59.99 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 116.266 -0.424 . . . . 73.33 111.622 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.612 ' ND2' HG23 ' A' ' 79' ' ' ILE . 61.0 m-80 -137.03 91.56 14.82 Favored Pre-proline 0 N--CA 1.473 0.702 0 O-C-N 122.237 -0.289 . . . . 73.01 111.257 174.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.75 141.47 12.18 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.019 2.479 . . . . 74.21 113.615 176.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -141.78 131.26 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-O 121.042 0.449 . . . . 73.32 111.231 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.34 110.11 9.42 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.227 -0.296 . . . . 74.42 110.457 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -114.07 -146.59 0.41 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 121.2 -0.2 . . . . 74.32 111.264 -171.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 t -62.15 89.73 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.661 0.743 . . . . 75.41 112.494 -176.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.3 m -63.96 142.97 16.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 115.878 -0.601 . . . . 74.34 110.568 173.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.13 69.48 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.587 0.588 . . . . 72.43 112.587 -173.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.4 p -67.75 -21.11 65.29 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.085 0.402 . . . . 75.21 112.085 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.32 -40.27 14.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.903 0.382 . . . . 73.21 111.809 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.3 t -81.47 -35.64 30.28 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.45 0.537 . . . . 65.42 112.45 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -94.47 120.19 34.33 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.084 0.469 . . . . 75.5 111.781 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -78.61 110.2 13.51 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.283 -0.417 . . . . 72.5 111.318 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 83.69 46.1 6.16 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 121.167 -0.54 . . . . 72.24 113.136 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -149.5 108.79 3.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 120.999 0.428 . . . . 74.12 111.82 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -80.25 64.57 5.11 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.571 0.7 . . . . 72.41 111.302 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.418 HG11 ' N ' ' A' ' 97' ' ' ASP . 18.1 t -95.07 161.78 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.945 -0.571 . . . . 75.35 111.141 -178.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.418 ' N ' HG11 ' A' ' 96' ' ' VAL . 15.0 m-20 -59.97 168.97 1.63 Allowed 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.652 0.982 . . . . 73.21 113.652 -176.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 -104.17 146.3 28.97 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-N 115.847 -0.615 . . . . 74.52 111.858 -177.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -112.67 126.65 55.62 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.54 -0.755 . . . . 75.4 112.946 -171.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.413 ' HB ' HG23 ' A' ' 59' ' ' VAL . 57.3 mt -111.07 115.93 51.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.197 -0.91 . . . . 74.51 110.291 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -84.8 134.85 34.3 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.078 -0.389 . . . . 75.34 110.898 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.1 143.96 50.92 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.227 0.537 . . . . 61.3 112.165 -176.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.0 t70 -65.01 -40.03 94.31 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.884 -0.598 . . . . 72.21 111.422 176.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.429 ' HB3' HG13 ' A' ' 79' ' ' ILE . 22.1 t0 -170.42 161.61 8.03 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 116.383 -0.371 . . . . 75.53 110.817 178.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 36.5 mt -122.66 122.13 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 116.527 -0.306 . . . . 74.12 111.302 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.7 m -126.35 176.57 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.64 0.257 . . . . 72.33 111.026 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.462 HD23 HG13 ' A' ' 76' ' ' VAL . 97.2 mt -76.05 145.41 40.17 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.176 -0.327 . . . . 73.31 111.417 177.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.9 m -62.69 119.45 9.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.595 0.236 . . . . 75.33 110.873 177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.1 mt 61.33 36.04 17.75 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.222 0.534 . . . . 74.4 111.106 -174.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 C--O 1.255 1.377 0 CA-C-N 115.597 -0.728 . . . . 73.43 112.189 177.961 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 mtm . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.572 0.225 . . . . 75.21 111.088 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 50.3 mtm -130.68 134.91 47.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.678 0.275 . . . . 74.04 111.37 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -81.2 155.67 26.03 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.147 0.498 . . . . 73.53 111.235 175.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.49 148.47 24.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 72.34 111.399 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -112.13 90.98 3.49 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.337 -0.392 . . . . 73.22 111.895 -177.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -134.02 171.86 13.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.486 -0.324 . . . . 65.35 110.829 175.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.19 28.96 42.75 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 120.888 -0.672 . . . . 63.03 112.632 -176.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 33.0 pt -88.6 159.41 2.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.961 0.41 . . . . 72.44 111.588 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.9 t -102.87 128.47 55.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.826 0.346 . . . . 74.1 111.431 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.27 178.77 7.92 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.006 -0.543 . . . . 73.35 111.279 178.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -63.22 154.31 31.82 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 121.674 0.749 . . . . 72.33 112.519 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -155.59 -36.33 0.09 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.383 -0.826 . . . . 71.15 110.066 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -153.14 78.63 1.17 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.398 -0.819 . . . . 74.34 110.179 174.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -62.68 -20.39 64.81 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.784 -0.644 . . . . 75.53 112.688 -177.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.8 p -75.89 92.05 3.06 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.887 0.375 . . . . 71.1 111.12 178.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -64.61 118.86 9.48 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.34 -0.391 . . . . 61.44 111.387 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -71.12 -106.56 0.05 OUTLIER Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.068 -0.587 . . . . 65.12 113.069 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -95.3 124.8 39.53 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 122.362 -0.493 . . . . 74.4 111.996 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.6 mt -118.1 135.62 54.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.836 -0.62 . . . . 75.0 110.094 175.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HD2' ' O ' ' A' ' 73' ' ' ASN . 46.9 mtmt -132.83 138.81 47.2 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 122.036 -0.415 . . . . 73.52 112.027 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -70.2 140.03 52.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.057 0.391 . . . . 70.33 112.057 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 94.8 p -125.97 -62.39 1.18 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.011 0.374 . . . . 75.13 112.011 177.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -149.98 -173.6 4.48 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.494 0.553 . . . . 73.32 112.494 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 tp -104.85 123.79 48.32 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.237 -0.438 . . . . 75.25 110.754 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -73.16 -64.75 0.91 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.095 0.406 . . . . 74.44 112.095 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -170.16 143.45 2.44 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.071 0.462 . . . . 74.45 111.905 -174.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.425 ' HG2' ' HG3' ' A' ' 44' ' ' ARG . 43.3 mt-10 -106.13 108.96 20.75 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.18 -0.464 . . . . 74.53 110.481 173.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -85.95 110.05 19.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 121.304 0.573 . . . . 70.42 111.17 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.658 ' HG2' HG12 ' A' ' 41' ' ' ILE . 73.7 mtm180 -99.9 178.48 4.8 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.474 0.654 . . . . 73.24 112.761 -174.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.615 HG12 ' HZ1' ' A' ' 42' ' ' LYS . 65.1 mt -84.06 124.17 39.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.496 -0.774 . . . . 74.31 110.639 177.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -98.35 133.78 42.28 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.999 0.428 . . . . 74.43 111.698 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -68.94 143.72 54.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.249 -0.432 . . . . 72.41 110.741 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.59 -17.68 48.02 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.139 0.495 . . . . 75.11 111.636 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.12 -39.75 71.86 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.069 0.461 . . . . 75.03 111.253 174.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.5 -46.22 0.82 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.372 -0.442 . . . . 73.44 112.916 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.2 p -61.46 160.79 10.42 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 120.991 0.424 . . . . 55.41 111.931 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.4 t -107.97 136.89 41.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-O 121.024 0.44 . . . . 75.11 111.793 -177.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 t -79.83 168.88 18.7 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.272 0.558 . . . . 73.44 111.895 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.42 -26.74 55.82 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.206 -0.452 . . . . 74.1 111.813 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 142.69 57.94 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.268 0.556 . . . . 65.4 111.453 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.658 HG12 ' HG2' ' A' ' 29' ' ' ARG . 24.1 mt -115.48 145.04 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 116.066 -0.516 . . . . 65.42 111.934 -172.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.615 ' HZ1' HG12 ' A' ' 30' ' ' ILE . 38.7 mmtm -78.58 -57.79 3.59 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.146 0.498 . . . . 73.12 110.389 173.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.44 167.75 25.02 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.157 0.503 . . . . 64.4 111.478 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.425 ' HG3' ' HG2' ' A' ' 27' ' ' GLU . 44.8 ttm180 -125.51 123.71 39.76 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.927 0.394 . . . . 72.35 111.752 -172.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 16.9 m -102.3 128.84 48.68 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 116.2 -0.455 . . . . 75.5 112.175 -177.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -109.9 160.26 16.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.71 0.404 . . . . 74.44 111.369 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.05 124.1 42.39 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.476 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.42 ' HB2' HG13 ' A' ' 57' ' ' ILE . 73.3 mt -123.52 130.32 52.51 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.151 0.5 . . . . 74.53 111.535 178.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 49' ' ' LYS . 1.8 mmmp? -80.77 128.57 33.79 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.444 -0.344 . . . . 75.43 110.64 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -112.85 136.29 52.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.235 0.458 . . . . 61.22 112.235 -175.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.3 90.56 7.16 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.232 -0.44 . . . . 75.53 111.036 173.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.09 -130.35 1.12 Allowed Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.707 -0.759 . . . . 73.11 113.824 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 28.39 0.11 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 112.913 0.708 . . . . 73.33 112.913 -174.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 77.0 20.25 76.22 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.808 -0.71 . . . . 72.34 113.557 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -115.96 156.61 25.93 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.825 0.345 . . . . 72.43 110.935 177.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -108.55 177.62 4.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.691 0.281 . . . . 72.43 110.492 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.42 HG13 ' HB2' ' A' ' 48' ' ' LEU . 36.4 pt -131.62 138.24 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.962 0.41 . . . . 65.52 111.81 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.506 ' NE2' ' HB2' ' A' ' 97' ' ' ASP . 78.4 mt-30 -104.74 105.68 15.86 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.033 0.444 . . . . 74.11 110.622 175.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 93.5 t -100.07 126.59 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.308 0.484 . . . . 64.42 112.308 -173.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 14.3 t -114.03 123.07 48.78 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.712 0.291 . . . . 65.02 111.749 -176.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 pt -114.03 155.1 45.85 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.543 -0.299 . . . . 74.32 111.368 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.27 138.73 80.23 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 122.778 2.319 . . . . 73.24 113.297 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.74 -13.81 62.43 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.668 0.618 . . . . 73.12 112.668 -176.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.1 m -73.83 0.67 12.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 120.938 0.399 . . . . 71.52 111.169 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 94.5 t -101.77 129.96 25.52 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 122.816 0.446 . . . . 74.23 110.849 176.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.46 156.18 27.5 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.658 2.239 . . . . 74.42 113.438 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 39.7 tp -69.45 145.75 52.53 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.088 -0.506 . . . . 73.42 111.563 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.466 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 13.5 mptt -93.62 -66.13 0.94 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.986 0.736 . . . . 74.41 112.986 -176.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.534 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.1 mt-10 60.88 49.28 6.09 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.861 0.319 . . . . 65.44 111.861 -177.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.51 176.41 1.11 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.479 0.657 . . . . 73.13 112.644 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.497 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 16.7 m-20 -71.77 153.85 41.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.703 -0.68 . . . . 73.33 111.843 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -67.49 119.57 12.52 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.95 -0.568 . . . . 75.1 111.263 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.438 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 40.5 m-80 61.97 34.33 16.8 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.584 0.587 . . . . 74.32 112.584 -177.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -88.03 142.18 27.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.719 -0.219 . . . . 73.02 111.142 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 115.96 4.58 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.383 0.611 . . . . 75.12 112.388 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.5 m -125.31 146.94 30.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.587 -0.733 . . . . 71.51 111.208 177.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -125.65 162.99 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.313 0.577 . . . . 73.22 111.316 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.462 HD11 HG23 ' A' ' 59' ' ' VAL . 86.7 mt -110.17 137.67 47.59 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.226 -0.443 . . . . 75.22 111.731 -176.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.468 ' N ' HD13 ' A' ' 79' ' ' ILE . 1.9 mp -67.11 -68.42 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 116.286 -0.416 . . . . 74.34 110.925 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.472 ' O ' ' HA ' ' A' ' 102' ' ' ALA . 80.9 m-20 -122.72 85.99 49.56 Favored Pre-proline 0 N--CA 1.473 0.693 0 CA-C-N 116.679 -0.237 . . . . 75.02 111.191 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.73 129.81 6.52 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.808 2.339 . . . . 64.43 113.449 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.8 pt -137.86 130.97 41.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 121.162 0.506 . . . . 72.2 111.046 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.66 127.65 32.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.775 0.321 . . . . 72.51 111.425 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.43 131.63 51.66 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.152 0.427 . . . . 72.51 112.152 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -76.42 80.63 3.14 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.549 0.69 . . . . 73.22 109.43 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.408 HG22 ' N ' ' A' ' 87' ' ' ALA . 10.7 p -125.34 174.0 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 115.477 -0.783 . . . . 74.4 110.894 -172.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.408 ' N ' HG22 ' A' ' 86' ' ' VAL . . . 79.5 -57.87 0.39 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.341 0.657 . . . . 71.53 111.714 176.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.0 t -62.08 -12.43 19.15 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.058 0.392 . . . . 75.22 112.058 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -102.37 0.72 34.48 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.017 0.377 . . . . 65.12 112.017 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 84.1 m -119.08 -38.55 3.04 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.254 0.549 . . . . 73.02 111.045 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -93.65 -177.74 4.48 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.017 -0.538 . . . . 75.25 110.675 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -65.76 -16.34 63.7 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.186 0.517 . . . . 75.13 111.351 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 101.36 54.84 0.93 Allowed Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.162 -0.472 . . . . 73.33 113.011 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.36 2.14 20.5 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.304 0.573 . . . . 52.3 111.347 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -82.52 107.58 15.27 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.227 0.536 . . . . 71.31 111.148 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.9 t -87.94 -34.59 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.049 0.452 . . . . 73.22 111.548 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.506 ' HB2' ' NE2' ' A' ' 58' ' ' GLN . 5.4 m-20 -84.66 146.93 27.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.088 -0.506 . . . . 72.44 111.16 -178.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -82.83 142.18 31.72 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.651 0.739 . . . . 73.53 112.607 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.2 138.93 34.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.483 -0.78 . . . . 73.41 112.061 -178.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.557 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 50.5 mt -124.67 114.64 41.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 115.724 -0.671 . . . . 74.2 110.142 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -83.4 139.12 33.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.068 -0.395 . . . . 74.5 110.387 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 80' ' ' ASN . . . -141.16 160.49 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.29 0.566 . . . . 61.51 112.39 -175.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.427 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 34.7 t70 -63.01 -55.39 26.04 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.606 -0.725 . . . . 64.14 110.986 175.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -163.19 164.85 25.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.11 -0.495 . . . . 74.24 110.896 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.466 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 52.3 mt -115.04 117.34 55.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.087 0.555 . . . . 74.22 111.234 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.34 175.28 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.154 -0.341 . . . . 75.32 111.425 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.12 138.13 39.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.723 0.297 . . . . 74.22 111.45 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.5 m -61.74 138.16 58.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.902 0.382 . . . . 72.33 111.758 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.6 mt -71.71 80.14 0.85 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 74.22 111.863 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.664 -0.684 . . . . 75.45 110.689 175.351 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.673 0.273 . . . . 73.23 110.976 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 34.4 tpp -148.95 152.92 37.19 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.874 0.369 . . . . 73.33 111.249 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -98.25 18.96 15.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.125 0.417 . . . . 70.22 112.125 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -113.43 -179.88 3.77 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.894 0.378 . . . . 65.43 111.574 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.48 134.8 55.05 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.46 -0.336 . . . . 63.11 111.164 179.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -106.44 -26.91 11.24 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 111.887 0.329 . . . . 74.24 111.887 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.31 116.29 1.31 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 121.162 -0.542 . . . . 75.13 112.997 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 34.4 pt -86.58 136.84 22.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 121.335 0.588 . . . . 72.14 112.214 -177.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.63 -47.14 72.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 121.285 0.564 . . . . 75.34 110.931 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -150.35 -177.3 5.87 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.936 -0.575 . . . . 74.23 111.054 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -60.87 102.84 0.22 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.163 0.506 . . . . 75.52 110.94 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.435 ' HB3' ' HE3' ' A' ' 12' ' ' LYS . 1.0 OUTLIER -56.51 138.75 51.25 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.667 -0.697 . . . . 73.34 112.705 -172.704 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.434 ' CG ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -47.86 102.56 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.702 -0.681 . . . . 74.21 111.779 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.8 t -124.81 -35.91 2.64 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.083 0.468 . . . . 71.13 111.226 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.2 p -88.45 83.41 6.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.228 0.537 . . . . 75.13 110.707 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.531 ' HD1' ' HG ' ' A' ' 50' ' ' SER . 91.5 m-85 -82.28 142.89 31.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.12 -0.491 . . . . 72.44 111.529 -178.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -73.21 -157.34 4.15 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.743 -0.741 . . . . 43.11 111.842 171.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.61 107.97 2.29 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.049 -0.677 . . . . 73.42 110.816 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 95.3 mt -74.75 127.65 33.67 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.773 0.32 . . . . 71.42 110.58 177.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.461 ' HB2' ' HD3' ' A' ' 49' ' ' LYS . 57.6 mttp -112.78 130.77 55.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.911 0.386 . . . . 72.21 111.387 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.85 132.39 48.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.92 -0.582 . . . . 64.12 111.207 177.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 m -116.75 -64.31 1.33 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.894 0.378 . . . . 72.52 111.607 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.68 -175.41 5.14 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.06 0.457 . . . . 73.0 111.894 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -105.89 107.24 18.14 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.166 -0.47 . . . . 72.4 110.127 175.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -59.01 -52.88 63.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.547 0.573 . . . . 75.4 112.547 -174.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -174.42 134.93 0.41 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.77 0.656 . . . . 73.22 112.77 -174.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -105.18 106.16 16.53 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.34 -0.391 . . . . 73.04 110.351 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -78.36 113.1 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.066 0.46 . . . . 72.33 111.505 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.624 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 96.0 mtt180 -79.95 161.96 25.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.278 0.561 . . . . 74.55 112.375 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -77.01 105.5 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 115.721 -0.672 . . . . 74.13 111.267 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 64.4 tt0 -77.85 121.18 23.76 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.891 0.377 . . . . 72.44 111.23 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -65.84 147.21 53.74 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.942 0.401 . . . . 74.11 111.574 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -63.33 -13.96 44.66 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.122 -0.49 . . . . 74.53 111.465 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.51 -23.93 61.08 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.049 0.452 . . . . 74.41 111.342 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.75 -42.87 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.442 -0.408 . . . . 72.21 112.97 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.0 m -74.5 159.88 31.66 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.093 0.473 . . . . 73.12 111.903 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 50.1 t -92.59 137.08 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.889 0.376 . . . . 71.33 111.527 -178.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.8 t -79.64 179.67 7.37 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.396 0.617 . . . . 73.34 111.884 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -78.49 -44.95 23.23 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.034 -0.53 . . . . 74.21 110.997 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -72.82 157.6 37.16 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.244 0.831 . . . . 62.52 113.244 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.624 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 34.2 mt -104.06 152.44 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.442 -0.799 . . . . 54.34 111.699 -176.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -91.95 -58.34 2.43 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.045 0.45 . . . . 73.53 111.254 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -153.97 160.66 42.16 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 120.882 0.372 . . . . 65.11 111.217 176.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 44' ' ' ARG . 5.5 ptp85 -125.63 126.44 44.73 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.563 0.579 . . . . 74.2 112.563 -174.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.8 m -96.6 129.12 44.05 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.735 -0.666 . . . . 74.21 111.991 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.433 ' OH ' HD11 ' A' ' 67' ' ' LEU . 66.1 m-85 -107.82 163.53 13.04 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 121.23 0.538 . . . . 71.3 112.138 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -106.94 108.35 19.82 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.58 -0.736 . . . . 73.52 111.472 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.9 mt -122.64 125.92 46.6 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 122.29 -0.256 . . . . 74.41 110.895 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HD3' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -94.11 134.48 36.5 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.87 -0.518 . . . . 73.34 112.022 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.531 ' HG ' ' HD1' ' A' ' 16' ' ' PHE . 47.9 t -100.91 118.76 37.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.149 -0.478 . . . . 74.3 111.442 -178.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -66.6 123.84 21.18 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.52 -0.309 . . . . 73.14 111.474 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.51 -31.39 6.91 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.268 -0.491 . . . . 75.11 113.598 177.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -96.26 -12.83 23.97 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 117.256 0.528 . . . . 73.21 112.02 -177.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.1 12.83 66.1 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 114.28 0.472 . . . . 63.33 114.28 177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.434 HH21 ' CG ' ' A' ' 13' ' ' ASP . 38.7 ptt180 -138.44 160.42 39.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 122.261 -0.553 . . . . 73.12 111.942 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.476 ' SD ' ' N ' ' A' ' 56' ' ' MET . 1.5 pmm? -102.14 147.69 26.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.857 -0.611 . . . . 74.4 111.377 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.8 pt -103.52 137.82 30.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.025 177.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -93.45 104.68 16.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.182 -0.463 . . . . 70.42 110.394 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -105.36 112.43 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.813 0.34 . . . . 64.34 111.728 -175.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 98.2 p -103.91 130.74 51.54 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.269 0.557 . . . . 72.32 111.874 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -125.21 152.36 70.81 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 116.127 -0.488 . . . . 74.21 111.095 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.78 142.54 41.38 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.716 2.277 . . . . 74.23 113.508 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.52 -30.81 69.97 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.925 0.393 . . . . 75.43 111.966 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.9 t -61.08 -22.74 64.9 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.087 0.47 . . . . 74.44 111.306 176.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.83 127.81 84.76 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 116.462 -0.336 . . . . 71.44 110.547 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.38 144.01 92.56 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.917 2.411 . . . . 74.43 113.741 -175.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.433 HD11 ' OH ' ' A' ' 46' ' ' TYR . 24.3 tp -60.45 146.71 43.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.468 -0.787 . . . . 73.52 110.608 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HD2' ' N ' ' A' ' 68' ' ' LYS . 3.6 mptp? -88.09 -56.79 3.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.95 0.722 . . . . 63.24 112.95 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 59.65 21.95 10.65 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.569 0.581 . . . . 73.03 112.569 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.21 164.98 14.64 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.2 0.524 . . . . 74.54 112.172 -177.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -65.1 146.91 54.37 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.432 0.634 . . . . 60.31 112.568 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.09 123.94 19.49 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.434 -0.803 . . . . 73.44 111.627 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.0 m120 71.03 16.71 6.36 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.21 0.604 . . . . 64.43 112.53 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.21 149.06 32.03 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.149 -0.344 . . . . 75.11 111.09 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.56 123.85 22.38 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.911 0.386 . . . . 74.52 111.427 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.47 HG11 HD23 ' A' ' 107' ' ' LEU . 30.4 m -127.21 140.47 49.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 121.052 0.453 . . . . 74.52 111.075 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -123.73 153.33 41.04 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.202 0.525 . . . . 75.23 111.151 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.417 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.7 mt -93.61 146.46 23.8 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.195 -0.457 . . . . 75.11 111.732 -177.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.523 HG23 ' ND2' ' A' ' 80' ' ' ASN . 49.6 mm -77.0 -67.32 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.24 -0.436 . . . . 74.44 111.005 176.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.523 ' ND2' HG23 ' A' ' 79' ' ' ILE . 51.7 m-80 -124.42 88.19 53.4 Favored Pre-proline 0 N--CA 1.473 0.714 0 O-C-N 122.2 -0.312 . . . . 73.34 110.838 174.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.32 128.52 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.946 2.431 . . . . 73.43 113.868 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.6 pt -137.58 123.83 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.166 0.508 . . . . 62.44 111.02 171.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 142.42 48.79 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 122.121 -0.362 . . . . 74.13 110.381 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -119.78 143.41 47.85 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.317 0.58 . . . . 73.41 112.095 -175.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.2 p -84.42 6.62 22.6 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.939 -0.573 . . . . 64.53 111.878 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.38 -32.3 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 72.24 111.177 176.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.95 -57.54 4.47 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.266 -0.425 . . . . 75.43 111.411 177.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.6 p -60.46 -18.06 48.92 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 112.737 0.643 . . . . 71.15 112.737 -176.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.1 -40.27 84.83 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.871 0.367 . . . . 70.41 111.798 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.8 t -108.6 -34.98 6.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.011 0.434 . . . . 72.14 111.509 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -75.57 104.95 6.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.889 0.376 . . . . 75.4 111.519 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.39 118.63 13.44 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.302 -0.408 . . . . 71.14 111.826 178.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 79.58 -108.1 2.67 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 121.423 -0.418 . . . . 73.43 113.912 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -153.39 137.63 16.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.971 0.415 . . . . 73.55 111.847 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -124.82 32.0 5.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.068 0.461 . . . . 75.51 111.227 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 68.2 t 74.81 -60.01 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.565 0.746 . . . . 72.34 112.669 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.61 152.54 23.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.158 0.504 . . . . 74.4 111.266 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -149.23 164.76 33.88 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.101 0.477 . . . . 74.23 111.63 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -111.05 128.65 55.93 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.029 0.751 . . . . 61.22 113.029 -171.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 66.4 mt -120.57 128.36 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.279 -0.873 . . . . 75.24 110.527 177.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.35 131.4 42.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.905 0.383 . . . . 74.3 110.278 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.65 162.92 24.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.513 0.673 . . . . 72.53 112.605 -176.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -78.3 -40.55 36.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.19 -0.914 . . . . 74.04 111.425 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -169.44 155.89 6.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.003 0.43 . . . . 73.35 111.46 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.444 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 31.7 mt -120.92 118.68 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 115.892 -0.595 . . . . 74.45 110.722 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.9 m -122.75 168.93 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 120.934 0.397 . . . . 73.01 111.626 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.47 HD23 HG11 ' A' ' 76' ' ' VAL . 69.2 mt -74.73 133.57 42.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.809 0.338 . . . . 72.15 111.494 176.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.36 137.35 58.24 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.475 -0.33 . . . . 73.44 110.381 176.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.17 12.62 0.41 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.093 0.775 . . . . 74.33 113.093 -173.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--O 1.25 1.114 0 C-N-CA 123.696 0.798 . . . . 71.25 112.822 176.464 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.439 ' N ' ' OE1' ' A' ' 31' ' ' GLN . 64.3 mtt . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.615 0.245 . . . . 74.2 111.278 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.523 ' HE2' HD23 ' A' ' 4' ' ' LEU . 25.2 ptt? -176.11 150.1 0.93 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.881 0.372 . . . . 64.21 111.476 -179.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -110.02 111.41 22.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.306 -0.406 . . . . 74.34 110.412 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.523 HD23 ' HE2' ' A' ' 2' ' ' MET . 3.6 mm? -81.09 123.33 28.3 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.249 0.547 . . . . 72.43 112.247 -177.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -105.08 104.2 13.89 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.95 -0.568 . . . . 74.3 110.849 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -114.23 171.88 7.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.27 0.557 . . . . 74.23 111.89 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -156.57 -96.99 0.13 Allowed Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.794 -0.639 . . . . 44.13 112.107 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 40.5 pt -110.03 171.03 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.928 0.394 . . . . 72.32 111.413 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.6 p -147.99 113.06 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.257 0.551 . . . . 74.42 110.835 174.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -113.2 -178.14 3.31 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.221 -0.445 . . . . 71.31 111.905 -177.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -64.25 110.35 2.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.04 -0.527 . . . . 74.3 112.374 -175.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -130.82 -173.19 3.01 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.03 0.443 . . . . 72.35 111.413 175.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.01 119.08 14.61 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.528 0.566 . . . . 73.4 112.528 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 t -93.21 -50.57 5.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.958 -0.565 . . . . 63.24 110.503 171.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.1 m 67.26 -65.25 0.23 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.62 1.341 . . . . 65.43 114.62 170.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -52.48 -32.13 38.44 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.56 0.948 . . . . 65.31 113.56 -170.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 68.53 -113.79 5.53 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 121.021 -0.609 . . . . 74.02 113.155 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' A' ' 18' ' ' GLU . 7.3 pt-20 -83.85 108.63 16.98 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.352 0.596 . . . . 73.35 111.767 179.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 96.8 mt -88.85 153.43 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.933 -0.479 . . . . 75.5 111.306 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.521 ' N ' ' HE2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -102.62 112.93 25.9 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.483 -0.326 . . . . 75.12 111.075 176.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.45 ' HE1' ' CD1' ' A' ' 46' ' ' TYR . 86.0 t80 -78.82 113.25 16.74 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.254 -0.43 . . . . 73.25 111.742 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.6 p -101.19 -60.09 1.59 Allowed 'General case' 0 N--CA 1.474 0.741 0 O-C-N 122.109 -0.37 . . . . 74.34 111.919 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.16 173.95 15.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.91 0.707 . . . . 42.24 112.91 -178.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -92.65 116.65 29.2 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.525 -0.761 . . . . 73.42 110.984 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 19.3 tpt180 -71.51 -54.61 10.0 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.405 0.52 . . . . 73.5 112.405 -173.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -164.7 146.9 8.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.081 0.467 . . . . 75.25 111.922 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.4 mt-10 -114.03 99.39 7.61 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.018 -0.537 . . . . 64.21 110.501 175.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -71.91 120.57 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.358 0.599 . . . . 70.34 110.702 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.553 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.2 mtt180 -98.16 165.94 11.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.349 0.595 . . . . 75.53 112.301 -173.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.9 mt -69.34 112.51 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.659 -0.7 . . . . 72.14 111.319 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' A' ' 1' ' ' MET . 58.3 tt0 -86.51 120.18 27.56 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.14 -0.482 . . . . 72.12 110.838 -178.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.05 173.7 5.25 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.132 0.79 . . . . 75.4 113.132 -174.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -53.98 -41.5 67.97 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.55 -0.75 . . . . 65.11 112.344 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.7 -26.93 68.88 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.068 0.461 . . . . 72.34 112.053 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.14 -15.97 30.34 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.07 -0.586 . . . . 71.01 111.788 -171.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 m -72.14 137.84 47.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.006 0.431 . . . . 71.42 110.9 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.08 144.31 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-N 116.372 -0.377 . . . . 73.25 111.876 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.8 t -95.3 176.44 6.21 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.915 0.388 . . . . 54.33 111.794 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -80.11 -29.87 39.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.943 0.401 . . . . 73.54 111.252 177.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.03 138.97 58.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.277 -0.42 . . . . 74.43 111.031 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.3 mt -101.81 147.93 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 112.059 0.392 . . . . 73.21 112.059 -175.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -94.74 -57.31 2.5 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 116.535 -0.302 . . . . 73.41 110.87 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -152.26 165.7 34.07 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.986 0.422 . . . . 73.11 111.857 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.514 ' HD3' HD11 ' A' ' 67' ' ' LEU . 64.9 mtt180 -128.8 137.66 51.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.932 0.396 . . . . 74.52 112.049 -172.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.4 m -113.57 132.49 55.7 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.369 -0.378 . . . . 73.33 111.936 -177.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.526 ' HH ' HD12 ' A' ' 61' ' ' ILE . 51.5 m-85 -109.6 157.67 18.8 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 120.774 0.321 . . . . 74.31 111.751 178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.4 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 55.3 m-20 -92.45 106.77 18.7 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.295 -0.411 . . . . 74.41 110.233 169.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.447 HD12 HG23 ' A' ' 59' ' ' VAL . 58.9 mt -115.45 134.08 55.43 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.146 0.498 . . . . 71.53 111.846 -178.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.96 128.74 40.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.162 -0.472 . . . . 72.41 111.003 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 61.5 p -91.88 165.9 13.0 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.479 0.548 . . . . 64.5 112.479 -175.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.633 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 8.3 mmpt? -96.68 -178.16 4.16 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.135 -0.484 . . . . 75.23 111.543 177.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.4 -85.85 0.05 OUTLIER Glycine 0 CA--C 1.525 0.706 0 C-N-CA 121.161 -0.542 . . . . 51.22 113.04 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -74.82 -31.63 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.87 0.367 . . . . 64.53 111.151 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.68 53.58 8.23 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 120.935 -0.65 . . . . 75.44 114.346 175.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -111.82 160.87 16.94 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.412 0.625 . . . . 75.24 111.938 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.8 OUTLIER -87.72 125.12 34.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.449 -0.796 . . . . 74.03 110.86 176.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.489 HD11 HD12 ' A' ' 100' ' ' ILE . 27.0 pt -125.5 141.12 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.975 0.417 . . . . 75.03 111.823 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 22.1 mp0 -95.68 105.93 17.98 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.989 0.424 . . . . 64.2 111.325 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.447 HG23 HD12 ' A' ' 48' ' ' LEU . 93.4 t -100.01 128.47 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.652 0.263 . . . . 75.4 111.218 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.449 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 22.6 t -118.33 138.96 52.04 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.325 0.491 . . . . 74.43 112.325 -174.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.526 HD12 ' HH ' ' A' ' 46' ' ' TYR . 44.7 pt -133.76 149.01 70.74 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.282 -0.417 . . . . 71.25 111.109 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.44 145.48 94.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.433 2.089 . . . . 74.15 113.125 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -6.07 19.53 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.975 0.417 . . . . 64.42 112.073 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 55.3 p -74.02 -20.83 60.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.183 0.516 . . . . 74.34 110.679 172.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.6 t -89.78 124.8 62.93 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 115.849 -0.614 . . . . 73.2 110.864 177.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -49.73 126.42 16.44 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.813 2.342 . . . . 75.54 113.448 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.59 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 29.4 tp -56.75 126.32 26.34 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.074 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.483 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -69.72 -63.07 1.15 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.923 0.712 . . . . 74.34 112.923 -170.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.59 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 36.7 mt-10 56.25 45.61 22.79 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.757 0.651 . . . . 62.44 112.757 176.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -75.6 -169.17 0.98 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.824 0.345 . . . . 74.23 111.854 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -74.94 164.73 26.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.627 0.603 . . . . 73.21 112.627 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -70.92 125.4 26.73 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.863 -0.608 . . . . 72.11 111.113 -178.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 59.16 31.54 21.35 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 122.854 0.462 . . . . 72.04 111.878 -175.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.65 150.8 30.84 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.517 -0.31 . . . . 75.54 111.518 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.463 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 99.3 mtt180 -68.49 106.19 2.47 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.299 0.481 . . . . 73.12 112.299 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 35.7 m -123.2 141.65 42.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.422 -0.354 . . . . 75.34 111.095 174.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -128.82 164.71 22.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.333 0.587 . . . . 75.33 111.391 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.454 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.5 mt -102.24 136.65 41.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.968 -0.56 . . . . 62.41 112.025 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.556 HG22 ' ND2' ' A' ' 80' ' ' ASN . 49.7 mm -70.96 -76.14 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.184 -0.462 . . . . 73.54 111.417 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.556 ' ND2' HG22 ' A' ' 79' ' ' ILE . 44.8 m-80 -121.25 85.39 41.88 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.171 -0.33 . . . . 64.12 110.525 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -82.46 149.07 14.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.113 2.542 . . . . 74.34 114.703 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.7 pt -128.58 139.69 51.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.171 0.51 . . . . 74.1 110.122 168.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.66 105.75 17.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.286 -0.416 . . . . 71.52 111.859 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -81.9 49.41 1.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.293 0.568 . . . . 74.32 112.023 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 69.3 p -59.85 -44.21 94.24 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.929 0.395 . . . . 74.34 111.721 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -59.4 -18.26 14.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.831 0.678 . . . . 71.25 112.831 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -44.11 86.08 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.749 0.309 . . . . 73.2 111.655 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 78.7 p -63.37 -58.74 6.11 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.908 0.385 . . . . 72.44 111.34 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.436 ' HA ' ' O ' ' A' ' 93' ' ' GLY . . . -56.05 -36.9 68.55 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.487 0.551 . . . . 61.14 112.487 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.7 m -76.05 -53.99 7.52 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.408 0.521 . . . . 64.43 112.408 -177.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.86 -32.38 19.03 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.991 0.737 . . . . 73.01 112.991 -171.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -135.64 75.23 1.55 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 111.974 0.361 . . . . 74.15 111.974 -175.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.436 ' O ' ' HA ' ' A' ' 89' ' ' ALA . . . 44.75 -90.49 0.01 OUTLIER Glycine 0 CA--C 1.53 0.973 0 CA-C-N 115.893 -0.594 . . . . 74.2 114.463 176.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.37 80.03 0.67 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.116 0.566 . . . . 74.22 110.459 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -90.99 166.6 12.93 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.158 0.429 . . . . 61.34 112.158 -173.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.94 -39.95 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 113.133 0.79 . . . . 71.22 113.133 -172.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 140.64 30.6 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.315 0.579 . . . . 72.41 111.03 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 -139.4 165.44 27.2 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.023 -0.535 . . . . 72.32 112.238 -170.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 76.2 m-85 -105.16 154.22 20.48 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.749 -0.66 . . . . 72.33 112.253 -177.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.489 HD12 HD11 ' A' ' 57' ' ' ILE . 66.7 mt -135.85 107.39 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.427 -0.806 . . . . 75.3 109.76 175.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.455 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.3 mtpp -86.13 120.88 27.99 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.363 0.601 . . . . 72.24 111.101 -177.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.09 144.33 43.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.098 0.475 . . . . 74.12 112.165 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -56.31 -44.38 79.84 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.895 -0.593 . . . . 73.15 111.133 173.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -165.34 158.09 15.82 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.162 -0.472 . . . . 75.33 110.95 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.483 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 23.8 mt -123.43 122.46 65.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.093 -0.503 . . . . 72.02 110.915 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.5 m -124.62 177.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.608 0.242 . . . . 71.21 111.261 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.4 mt -76.96 137.91 39.33 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 122.411 -0.181 . . . . 75.35 110.792 174.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 32.5 m -54.95 132.62 47.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.755 0.312 . . . . 73.21 111.296 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.01 -28.59 17.6 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.815 0.672 . . . . 74.11 112.815 -176.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 C--O 1.254 1.317 0 CA-C-O 118.894 -0.574 . . . . 73.43 111.861 179.797 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.492 1.67 0 N-CA-C 111.754 0.279 . . . . 75.23 111.754 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.439 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -145.43 138.95 26.55 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.026 0.441 . . . . 75.31 111.743 -179.68 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -98.42 -6.21 30.99 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.296 -0.411 . . . . 74.14 112.025 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.484 ' HB3' HG13 ' A' ' 86' ' ' VAL . 3.9 pp -60.25 164.85 3.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.915 0.709 . . . . 75.21 112.915 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -127.6 156.2 42.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.094 -0.503 . . . . 75.21 111.695 178.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -90.75 7.16 41.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 120.957 0.408 . . . . 65.52 111.539 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -144.18 152.07 23.97 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 116.366 -0.379 . . . . 44.41 112.359 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 33.5 pt -105.04 177.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.466 0.651 . . . . 75.4 112.608 -175.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.5 t -77.94 -65.49 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 CA-C-N 115.759 -0.655 . . . . 62.55 110.881 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -157.54 171.7 19.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.335 -0.393 . . . . 72.14 111.472 178.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -125.0 166.67 15.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.225 -0.443 . . . . 72.54 110.947 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -153.08 -53.02 0.11 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.655 0.264 . . . . 75.44 110.903 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -147.52 114.08 6.0 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.227 0.537 . . . . 64.12 112.182 174.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.7 p -131.12 78.87 1.86 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.981 -0.554 . . . . 74.2 110.575 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 33.7 p -128.66 -52.06 1.25 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.294 -0.412 . . . . 53.13 111.652 -177.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.634 ' HB3' ' HB3' ' A' ' 50' ' ' SER . 53.1 m-85 61.92 17.39 8.89 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.509 0.559 . . . . 73.52 112.509 175.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 70.22 -112.51 4.39 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 121.022 -0.609 . . . . 41.4 112.835 -177.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -101.4 109.06 20.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.024 0.44 . . . . 74.44 111.501 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.44 126.29 33.12 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.475 -0.329 . . . . 72.21 110.291 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -127.84 133.47 49.38 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.146 0.498 . . . . 75.51 112.312 -178.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.49 ' HE1' ' HD2' ' A' ' 46' ' ' TYR . 65.7 t80 -77.84 114.75 17.0 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.719 -0.673 . . . . 74.45 111.555 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.7 m -97.39 -62.83 1.2 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.875 0.324 . . . . 64.33 111.875 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.21 171.08 20.85 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.465 0.543 . . . . 72.45 112.465 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -83.2 134.66 34.95 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.936 -0.574 . . . . 75.42 110.847 176.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -86.65 -58.74 2.49 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.646 0.26 . . . . 74.4 111.663 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -172.65 137.14 0.78 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.115 0.413 . . . . 72.32 112.115 -178.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -94.83 109.06 21.08 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.316 -0.402 . . . . 73.31 110.066 172.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.0 m -77.81 120.74 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 121.12 0.486 . . . . 72.35 111.31 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.452 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 62.6 mtm180 -104.44 -178.46 3.66 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.403 0.621 . . . . 73.54 112.293 -174.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.51 HG12 ' HE2' ' A' ' 42' ' ' LYS . 52.8 mt -99.42 118.85 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.909 -0.587 . . . . 71.32 111.806 -175.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.473 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 53.9 tt0 -85.51 118.19 24.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.055 0.455 . . . . 74.41 110.825 175.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.422 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.9 m-20 -74.29 167.54 21.42 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.959 0.725 . . . . 71.34 112.959 -172.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.49 -11.38 60.64 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.849 -0.614 . . . . 70.32 111.065 176.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -68.69 -32.02 71.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.281 0.562 . . . . 72.02 110.788 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.09 -33.26 5.11 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 115.859 -0.609 . . . . 71.12 111.952 -174.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.8 p -81.28 158.88 24.63 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.087 0.47 . . . . 64.03 111.27 176.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.473 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 38.3 t -93.66 125.02 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 120.712 0.291 . . . . 74.12 111.78 -177.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.422 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 41.0 t -65.77 152.71 43.7 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.094 0.473 . . . . 73.21 111.407 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.452 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 6.0 m-20 -77.45 -1.87 32.47 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.154 0.502 . . . . 61.13 111.064 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.9 142.48 45.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.137 -0.483 . . . . 73.03 110.682 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 62.5 mt -108.27 143.47 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.066 0.46 . . . . 74.45 112.079 -173.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.51 ' HE2' HG12 ' A' ' 30' ' ' ILE . 69.7 mmtt -88.29 -58.63 2.49 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.072 0.463 . . . . 73.54 110.616 171.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.478 ' CD ' ' HZ1' ' A' ' 101' ' ' LYS . 55.1 mt-10 -145.06 171.47 14.44 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.013 -0.539 . . . . 72.44 111.078 -177.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 45.7 ttm105 -134.07 114.81 13.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.435 -0.348 . . . . 64.12 111.386 -176.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.1 m -97.47 128.41 44.22 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.491 0.552 . . . . 73.03 112.491 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.49 ' HD2' ' HE1' ' A' ' 21' ' ' PHE . 80.1 m-85 -110.68 158.05 19.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.24 0.616 . . . . 74.45 111.365 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -99.94 107.22 19.14 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.525 -0.307 . . . . 74.43 110.484 170.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.9 mt -109.63 121.78 45.98 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.79 0.329 . . . . 74.23 110.849 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -76.05 144.39 40.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.07 0.462 . . . . 75.02 111.376 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.634 ' HB3' ' HB3' ' A' ' 16' ' ' PHE . 34.2 m -128.85 152.18 48.8 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.075 -0.511 . . . . 72.51 111.222 -177.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -96.1 -178.92 4.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.967 0.413 . . . . 72.54 111.542 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -102.42 2.92 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.313 -0.47 . . . . 74.45 112.925 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -68.11 -29.79 68.8 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.042 0.386 . . . . 75.25 112.042 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.45 -3.84 40.12 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.516 -0.373 . . . . 63.33 113.2 -178.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -89.94 140.23 29.83 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 122.771 -0.252 . . . . 65.44 110.46 177.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -95.67 -179.55 4.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.978 0.418 . . . . 75.53 111.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.512 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 30.7 pt -126.65 138.11 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 116.266 -0.424 . . . . 74.34 111.194 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -102.46 107.72 18.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.717 -0.614 . . . . 73.21 110.86 176.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 97.9 t -100.38 125.46 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.8 0.667 . . . . 74.31 112.8 -172.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -108.05 127.78 54.09 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.039 0.447 . . . . 74.11 111.315 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.4 HD11 ' HB ' ' A' ' 65' ' ' VAL . 37.0 pt -113.58 151.98 45.01 Favored Pre-proline 0 N--CA 1.473 0.675 0 CA-C-N 116.465 -0.334 . . . . 74.14 111.0 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.6 154.4 73.94 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.195 1.93 . . . . 72.42 112.766 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.58 -18.81 8.33 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.363 0.505 . . . . 75.41 112.363 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.2 m -60.89 -19.67 60.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.795 0.438 . . . . 73.22 111.998 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 24.2 t -114.48 120.02 38.77 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 116.666 -0.243 . . . . 75.13 110.893 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 16.7 Cg_exo -68.49 -172.43 0.45 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.033 2.489 . . . . 74.0 113.799 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.6 tp -72.1 147.41 46.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.049 -0.523 . . . . 75.5 111.092 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.468 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.9 mptp? -94.89 111.82 23.58 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.028 0.442 . . . . 75.22 111.388 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -80.74 65.03 5.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.205 0.526 . . . . 71.23 111.061 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -98.22 166.85 11.2 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.636 0.731 . . . . 70.31 112.304 -177.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.459 ' HB3' ' HB1' ' A' ' 74' ' ' ALA . 24.8 t70 -74.53 149.05 40.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.299 -0.864 . . . . 75.5 111.462 178.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.2 122.62 16.59 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.023 0.439 . . . . 75.44 111.642 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 64.07 30.23 13.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.1 0.56 . . . . 73.13 111.89 -177.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' HB1' ' HB3' ' A' ' 71' ' ' ASP . . . -80.59 151.33 29.14 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.719 0.295 . . . . 73.0 111.352 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -66.96 125.1 24.89 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.639 -0.255 . . . . 73.35 111.473 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.61 152.33 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 121.14 0.495 . . . . 73.22 112.007 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -137.69 169.52 17.64 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.858 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.5 mt -107.79 155.02 20.69 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.714 0.769 . . . . 72.34 113.053 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.5 mm -111.2 116.28 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 115.156 -0.929 . . . . 74.1 109.522 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 53.84 75.46 0.62 Allowed Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 122.645 0.378 . . . . 74.0 111.917 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.58 130.82 7.07 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.68 2.253 . . . . 62.21 114.104 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.463 HG13 ' HB2' ' A' ' 101' ' ' LYS . 48.7 pt -132.68 161.01 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.355 -0.384 . . . . 73.42 110.909 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.85 140.52 37.01 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.806 -0.558 . . . . 60.34 111.303 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.0 162.17 23.94 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 120.952 0.406 . . . . 74.33 110.989 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 4' ' ' LEU . 16.5 m -117.88 1.35 12.08 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.109 0.411 . . . . 72.35 112.109 -176.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.484 HG13 ' HB3' ' A' ' 4' ' ' LEU . 32.2 m -78.13 -175.27 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 121.909 -0.495 . . . . 70.13 111.581 177.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 67.65 7.52 5.72 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.085 0.469 . . . . 52.43 111.823 -179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.3 t -89.42 10.49 22.39 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.211 0.529 . . . . 72.54 111.06 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.86 94.33 8.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.054 -0.521 . . . . 73.25 111.704 -178.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 95.1 m 76.12 -23.76 0.23 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.312 0.856 . . . . 73.11 113.312 172.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -67.94 157.66 34.52 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.276 0.56 . . . . 72.11 112.509 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -75.66 143.91 41.94 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.036 -0.529 . . . . 73.41 112.094 -178.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.412 ' O ' ' HB1' ' A' ' 94' ' ' ALA . . . -72.85 65.65 1.46 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.459 -0.337 . . . . 51.52 113.183 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.412 ' HB1' ' O ' ' A' ' 93' ' ' GLY . . . 169.96 -26.36 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.388 0.675 . . . . 65.11 110.799 -176.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.89 -33.58 64.08 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.909 0.707 . . . . 72.42 112.909 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.1 t -78.11 127.44 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 112.47 0.544 . . . . 75.41 112.47 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.04 122.92 18.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.586 -0.524 . . . . 75.33 109.586 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.512 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -70.83 129.24 38.56 Favored 'General case' 0 C--O 1.249 1.047 0 CA-C-O 122.538 1.161 . . . . 74.35 114.027 -168.069 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -95.72 113.02 24.62 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.031 -1.441 . . . . 75.42 111.512 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 9.9 mt -96.11 165.46 2.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.544 -0.909 . . . . 74.22 108.544 172.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.478 ' HZ1' ' CD ' ' A' ' 43' ' ' GLU . 28.5 mtpt -140.27 163.84 31.69 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.567 -0.708 . . . . 74.45 110.762 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -154.34 156.01 36.13 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.054 0.454 . . . . 63.44 111.87 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -74.94 -21.96 58.87 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.061 -0.518 . . . . 73.52 110.29 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -171.24 160.88 6.41 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.168 0.509 . . . . 54.21 111.482 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.468 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 38.5 mt -127.34 123.59 62.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.154 -0.475 . . . . 72.23 110.814 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.3 m -128.75 -179.43 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 122.411 0.284 . . . . 73.4 111.125 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 98.0 mt -78.41 144.17 36.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.757 0.313 . . . . 71.41 111.142 176.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.4 HG21 ' HG2' ' A' ' 110' ' ' GLU . 25.7 m -63.31 118.76 8.47 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.924 0.392 . . . . 62.4 111.407 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 71.8 mt -80.66 69.47 7.18 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.129 0.49 . . . . 70.2 111.981 -177.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.4 ' HG2' HG21 ' A' ' 108' ' ' THR . 63.2 mm-40 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 118.901 -0.571 . . . . 70.24 110.658 176.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 120.905 0.384 . . . . 74.42 111.5 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -73.38 124.96 26.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.967 0.413 . . . . 75.23 111.2 176.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 4' ' ' LEU . 6.4 tmm_? -95.32 112.24 23.98 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.902 0.382 . . . . 74.5 110.394 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.527 ' O ' ' HD2' ' A' ' 3' ' ' ARG . 2.8 mm? -80.4 -177.19 6.06 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.975 0.417 . . . . 75.03 111.937 -177.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.69 177.5 2.02 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.807 0.669 . . . . 75.32 112.807 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -73.62 169.22 17.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.862 -0.608 . . . . 73.33 112.013 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.12 -60.2 4.71 Favored Glycine 0 CA--C 1.525 0.689 0 CA-C-N 116.172 -0.467 . . . . 52.23 113.482 177.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.3 pt -72.92 155.36 7.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 121.143 0.497 . . . . 74.34 111.933 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.1 t -81.63 136.58 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 116.171 -0.468 . . . . 75.34 111.358 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.467 HD21 ' H ' ' A' ' 4' ' ' LEU . 72.0 mt -74.94 160.66 30.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.762 0.315 . . . . 65.35 111.141 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.32 110.68 1.72 Allowed 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.213 0.53 . . . . 70.43 111.909 -175.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -135.32 109.07 8.04 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.658 -0.701 . . . . 63.54 110.633 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 57.48 99.29 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.473 0.545 . . . . 63.35 112.473 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.1 p -101.91 108.83 20.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.088 0.471 . . . . 73.13 111.803 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.3 p -107.57 160.39 15.71 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.137 -0.483 . . . . 63.32 110.939 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -80.66 106.33 12.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.73 0.3 . . . . 73.11 110.996 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.71 -99.63 1.08 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.346 -0.454 . . . . 37.32 113.507 -178.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.544 ' HG2' HG23 ' A' ' 108' ' ' THR . 51.5 mt-10 -104.0 121.12 42.51 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.542 -0.387 . . . . 64.13 111.49 -178.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -100.06 157.03 16.84 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.495 -0.32 . . . . 75.21 110.303 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -123.23 114.73 20.65 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.844 -0.535 . . . . 74.33 111.607 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -63.75 132.12 49.99 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.258 0.466 . . . . 71.12 112.258 -176.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.9 t -109.15 -65.01 1.18 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.131 0.419 . . . . 73.33 112.131 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.49 173.68 15.21 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.117 0.484 . . . . 63.21 112.06 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.2 tp -88.37 117.28 27.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.318 -0.401 . . . . 74.25 110.411 173.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -72.69 -62.38 1.47 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.969 0.414 . . . . 74.13 112.026 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -170.1 143.7 2.52 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.058 -0.519 . . . . 64.11 111.562 -175.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.0 mt-10 -105.23 103.66 13.24 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.375 -0.602 . . . . 65.51 109.375 170.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.518 HG23 ' HB2' ' A' ' 42' ' ' LYS . 15.9 m -67.25 102.03 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.587 0.708 . . . . 71.1 110.876 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.754 ' HG2' HG12 ' A' ' 41' ' ' ILE . 98.9 mtt180 -98.52 158.31 15.68 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.719 0.637 . . . . 74.03 112.719 -171.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.426 HG12 ' HZ1' ' A' ' 42' ' ' LYS . 66.5 mt -69.02 109.3 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.586 -0.733 . . . . 74.43 112.076 -175.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.444 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.0 tt0 -86.85 124.52 33.17 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.904 0.383 . . . . 74.22 110.332 174.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -70.43 155.44 40.69 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.795 0.331 . . . . 73.41 111.728 -178.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -23.71 62.72 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.407 0.623 . . . . 74.31 110.666 169.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.1 -28.06 64.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.652 -0.704 . . . . 71.04 111.499 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.81 -36.6 4.02 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 116.26 -0.427 . . . . 50.32 112.456 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.3 p -71.33 150.64 44.92 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 75.4 111.817 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 22.8 t -92.37 145.92 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.158 -0.474 . . . . 73.03 111.078 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.2 t -101.7 163.4 12.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.111 0.482 . . . . 74.2 111.835 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -77.54 -18.1 57.3 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.986 -0.552 . . . . 64.23 111.141 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.72 132.1 45.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.279 -0.419 . . . . 73.04 110.086 173.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.754 HG12 ' HG2' ' A' ' 29' ' ' ARG . 26.2 mt -109.84 147.47 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 112.069 0.396 . . . . 74.41 112.069 -169.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.518 ' HB2' HG23 ' A' ' 28' ' ' VAL . 39.7 mmtm -74.56 -61.06 2.0 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.416 -0.587 . . . . 72.13 109.416 169.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -155.26 167.23 31.05 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.384 -0.825 . . . . 63.35 110.022 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.445 ' HD3' ' OH ' ' A' ' 46' ' ' TYR . 4.3 ptp85 -122.7 133.72 54.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.161 0.505 . . . . 75.11 112.157 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.5 m -107.52 124.93 50.63 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.858 -0.61 . . . . 74.15 112.474 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.445 ' OH ' ' HD3' ' A' ' 44' ' ' ARG . 79.7 m-85 -110.81 153.66 25.05 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 122.88 0.472 . . . . 75.12 111.143 176.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.64 114.33 26.25 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.06 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.519 HD12 HG23 ' A' ' 59' ' ' VAL . 47.4 mt -114.21 132.34 56.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.569 0.7 . . . . 73.5 111.77 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.574 ' HZ3' ' HB3' ' A' ' 49' ' ' LYS . 2.6 mmmp? -93.28 150.99 20.07 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.557 -0.747 . . . . 73.2 111.16 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.2 m -115.6 120.2 38.65 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.871 0.367 . . . . 71.32 111.802 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -73.47 121.33 20.38 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.089 -0.505 . . . . 74.13 110.753 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.49 -102.9 0.65 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.085 -0.579 . . . . 75.1 113.825 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.45 HE21 ' HB2' ' A' ' 55' ' ' ARG . 5.5 pm0 -64.2 -11.52 31.74 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.114 0.783 . . . . 75.23 113.114 -175.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.83 16.59 72.36 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.728 -0.749 . . . . 70.24 114.316 175.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.45 ' HB2' HE21 ' A' ' 53' ' ' GLN . 36.9 mtt180 -78.89 161.95 26.37 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 117.455 0.628 . . . . 75.22 111.119 174.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.9 ttt -128.43 148.63 50.72 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.975 -0.557 . . . . 65.11 110.763 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 pt -135.48 135.44 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.918 0.389 . . . . 73.35 111.28 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -98.11 105.73 17.92 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.109 0.48 . . . . 62.31 110.494 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.519 HG23 HD12 ' A' ' 48' ' ' LEU . 70.1 t -94.41 129.98 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.343 -0.389 . . . . 74.32 111.715 -174.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 101' ' ' LYS . 39.9 m -118.38 141.82 48.15 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.944 0.402 . . . . 73.55 111.292 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.1 pt -131.24 150.97 78.0 Favored Pre-proline 0 CA--C 1.539 0.525 0 O-C-N 122.305 -0.247 . . . . 72.3 110.928 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HG2' HG22 ' A' ' 65' ' ' VAL . 12.2 Cg_endo -55.76 146.13 68.09 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.481 2.12 . . . . 73.22 112.974 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.49 -28.49 59.94 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.678 0.621 . . . . 62.2 112.678 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.0 m -62.23 -26.5 68.41 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.079 0.4 . . . . 63.41 112.079 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.471 HG22 ' HG2' ' A' ' 62' ' ' PRO . 51.0 t -79.01 125.05 84.48 Favored Pre-proline 0 CA--C 1.544 0.723 0 CA-C-N 116.841 -0.163 . . . . 74.32 110.996 179.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -64.73 161.35 36.3 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.408 . . . . 73.2 114.416 -174.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.7 tp -67.61 138.16 56.19 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.835 -0.621 . . . . 73.04 111.224 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.442 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.4 mptp? -81.84 -48.98 10.89 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.266 0.839 . . . . 74.42 113.266 -173.695 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 63.77 21.59 12.73 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.834 0.679 . . . . 73.13 112.834 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -64.66 159.5 21.9 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.009 0.433 . . . . 71.41 111.865 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.515 ' HB2' ' HB1' ' A' ' 74' ' ' ALA . 4.9 m-20 -68.06 154.22 42.1 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.409 0.623 . . . . 72.11 112.512 -177.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -65.02 133.53 51.88 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.718 -0.673 . . . . 73.43 111.178 174.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 63.3 19.54 11.74 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.189 0.596 . . . . 73.1 112.481 -177.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 71' ' ' ASP . . . -82.22 153.65 25.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.156 0.428 . . . . 71.25 112.156 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.528 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 65.4 mtt85 -70.77 104.35 2.86 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.954 -0.566 . . . . 73.54 112.111 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.435 HG11 HD22 ' A' ' 107' ' ' LEU . 31.8 m -120.13 153.06 23.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.099 -0.5 . . . . 75.13 111.273 177.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.402 ' HB3' ' HG1' ' A' ' 108' ' ' THR . 9.4 pt-20 -145.92 173.49 12.1 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.131 0.491 . . . . 75.45 111.064 176.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.458 HD23 HG12 ' A' ' 59' ' ' VAL . 81.8 mt -112.18 132.17 55.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.061 0.457 . . . . 72.02 111.981 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.583 HG21 ' ND2' ' A' ' 80' ' ' ASN . 48.5 mm -65.04 -59.54 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 115.916 -0.584 . . . . 72.42 111.337 178.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.583 ' ND2' HG21 ' A' ' 79' ' ' ILE . 47.5 m-80 -130.41 87.41 50.53 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 122.388 -0.195 . . . . 75.42 110.936 174.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.34 140.4 10.87 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.219 2.612 . . . . 71.32 114.509 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.8 pt -136.11 149.57 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 120.828 0.347 . . . . 64.13 110.858 172.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.35 117.36 29.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.579 0.228 . . . . 64.54 111.097 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.59 141.59 41.9 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.527 0.936 . . . . 72.53 113.527 -173.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.9 t -130.83 20.33 5.03 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.834 -1.076 . . . . 74.23 109.512 170.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.1 m -75.48 9.42 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 113.226 0.824 . . . . 70.03 113.226 -173.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.46 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . . . -79.27 53.85 1.57 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.404 0.621 . . . . 74.34 111.031 177.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.7 p -79.79 -18.39 51.1 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.908 -0.587 . . . . 75.1 112.326 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -89.54 92.85 9.27 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.887 0.375 . . . . 70.52 111.655 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.5 m 80.3 -29.99 0.13 Allowed 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.645 0.778 . . . . 63.21 113.038 174.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.46 ' HB2' ' HB3' ' A' ' 87' ' ' ALA . 97.0 m-85 -80.11 19.27 0.74 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.341 0.867 . . . . 75.02 113.341 -175.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -53.89 137.12 39.56 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.928 0.394 . . . . 73.32 111.458 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 105.74 62.92 0.62 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 121.229 -0.51 . . . . 73.54 113.287 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -124.5 76.57 1.5 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.189 0.519 . . . . 74.43 111.235 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -86.89 110.65 20.13 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.156 -0.475 . . . . 71.12 111.012 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.5 t 70.98 -51.58 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 123.429 0.692 . . . . 74.21 112.217 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -58.99 104.68 0.25 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.939 -0.393 . . . . 74.34 109.939 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -133.43 165.01 25.86 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.537 0.94 . . . . 75.15 113.537 -166.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.03 148.41 41.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.954 -1.021 . . . . 71.44 111.64 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 65.1 mt -129.01 115.04 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.106 -0.497 . . . . 53.14 110.24 177.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 60' ' ' SER . 45.7 mtpt -89.98 136.14 33.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 74.3 111.813 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.13 153.29 43.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.339 0.59 . . . . 71.43 112.068 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.539 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.6 t70 -63.94 -40.66 96.95 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.309 0.576 . . . . 72.14 111.028 173.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -165.22 158.49 16.5 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.742 -0.663 . . . . 72.53 111.112 179.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . 0.442 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 39.2 mt -119.01 123.23 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.136 -0.484 . . . . 73.12 111.25 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 36.0 m -128.12 -179.8 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 120.781 0.324 . . . . 73.11 111.75 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . 0.435 HD22 HG11 ' A' ' 76' ' ' VAL . 87.5 mt -91.58 138.16 31.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 75.32 111.435 177.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.544 HG23 ' HG2' ' A' ' 18' ' ' GLU . 8.3 m -75.71 153.72 36.9 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.046 -0.525 . . . . 70.31 111.452 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt 64.85 33.15 10.32 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.705 0.631 . . . . 74.34 112.705 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 . . . . . 0 C--O 1.255 1.346 0 CA-C-O 118.94 -0.552 . . . . 72.15 110.716 174.433 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 93.4 mt . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 109.598 -0.519 . . . . 72.329999999999998 109.598 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.567 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 59.1 mtmt -124.26 134.8 53.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.255 0.55 . . . . 73.430000000000007 111.689 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.79 144.36 57.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.404 -0.816 . . . . 73.530000000000001 113.012 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 71.7 m -123.55 -62.43 1.31 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.132 -0.485 . . . . 74.329999999999998 111.33 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.16 179.68 8.8 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.161 0.505 . . . . 50.240000000000002 111.916 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.2 tp -101.94 101.32 11.72 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.485 -0.561 . . . . 63.32 109.485 170.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HG2' ' OE1' ' A' ' 58' ' ' GLN . 10.4 tpp180 -58.3 -58.82 6.8 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.225 0.454 . . . . 71.120000000000005 112.225 -173.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -169.14 135.21 1.67 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.84 0.353 . . . . 74.109999999999999 111.73 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -98.82 98.14 9.27 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 110.006 -0.368 . . . . 70.420000000000002 110.006 174.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.49 135.84 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.805 0.336 . . . . 51.310000000000002 110.75 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.464 ' HG2' HD13 ' A' ' 41' ' ' ILE . 80.7 mtt180 -116.68 170.25 8.73 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.476 0.655 . . . . 74.230000000000004 112.742 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -75.1 113.65 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 115.577 -0.738 . . . . 73.140000000000001 111.385 -175.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -83.56 133.83 34.85 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.934 0.397 . . . . 63.399999999999999 111.932 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -80.6 150.25 29.58 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.544 -0.298 . . . . 61.43 110.858 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.22 -34.67 70.66 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.866 0.365 . . . . 65.510000000000005 111.97 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.53 -27.62 66.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.302 -0.408 . . . . 74.109999999999999 111.975 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.26 -57.52 0.64 Allowed Glycine 0 CA--C 1.524 0.64 0 C-N-CA 120.827 -0.701 . . . . 53.009999999999998 113.042 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.1 m -62.96 149.79 43.87 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.428 0.633 . . . . 72.140000000000001 112.375 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 39.5 t -90.94 147.55 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.979 -0.555 . . . . 72.319999999999993 111.228 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -81.31 174.54 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.574 0.702 . . . . 72.25 112.123 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -88.23 -10.4 49.87 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.535 -0.757 . . . . 72.129999999999995 111.225 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 29' ' ' ARG . 21.9 mm-40 -81.89 144.04 31.25 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.125 0.488 . . . . 71.230000000000004 111.871 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.464 HD13 ' HG2' ' A' ' 29' ' ' ARG . 20.7 mm -85.08 153.43 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.945 -0.571 . . . . 53.25 112.323 -172.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -113.9 -58.17 2.18 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 116.343 -0.39 . . . . 72.540000000000006 110.107 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -141.13 160.46 40.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.051 0.54 . . . . 72.450000000000003 110.825 172.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 44' ' ' ARG . 37.7 mtt180 -119.05 117.46 28.82 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.595 0.236 . . . . 75.450000000000003 110.899 178.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.0 m -96.2 121.35 37.89 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 111.91 0.337 . . . . 54.350000000000001 111.91 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.407 ' OH ' HD12 ' A' ' 67' ' ' LEU . 55.8 m-85 -108.47 153.92 22.64 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.235 0.541 . . . . 72.319999999999993 112.021 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -97.0 112.58 24.27 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.757 -0.656 . . . . 74.549999999999997 110.716 174.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.654 HD12 HG21 ' A' ' 59' ' ' VAL . 81.4 mt -123.66 137.42 54.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.691 0.282 . . . . 71.530000000000001 111.19 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.52 140.46 32.73 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.763 0.316 . . . . 72.239999999999995 110.418 174.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 121.131 0.491 . . . . 73.120000000000005 111.486 -179.085 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 112.296 0.48 . . . . 73.5 112.296 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.4 ptp -72.92 118.69 16.17 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.234 -0.439 . . . . 72.510000000000005 109.983 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.9 pt -94.74 138.08 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-O 120.996 0.426 . . . . 71.409999999999997 111.947 -173.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.495 ' OE1' ' HG2' ' A' ' 25' ' ' ARG . 25.2 mm-40 -93.16 104.71 16.88 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.24 -0.436 . . . . 75.549999999999997 110.977 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.654 HG21 HD12 ' A' ' 48' ' ' LEU . 81.0 t -98.49 116.16 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-O 120.875 0.369 . . . . 73.230000000000004 111.481 -177.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.9 t -111.06 123.93 51.16 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.872 0.368 . . . . 43.109999999999999 111.697 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.401 HD12 ' CG1' ' A' ' 65' ' ' VAL . 32.0 pt -115.31 147.06 37.79 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.328 -0.396 . . . . 70.049999999999997 110.944 176.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.95 157.61 51.83 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 122.325 2.017 . . . . 70.049999999999997 113.698 -177.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.01 -33.27 66.99 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.879 0.696 . . . . 61.240000000000002 112.879 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 58.4 m -58.32 -19.42 34.83 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.737 0.303 . . . . 45.229999999999997 111.721 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG1' HD12 ' A' ' 61' ' ' ILE . 43.9 t -91.31 126.07 56.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-N 116.545 -0.298 . . . . 73.209999999999994 110.829 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.78 162.1 43.38 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.406 2.07 . . . . 71.420000000000002 113.149 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.407 HD12 ' OH ' ' A' ' 46' ' ' TYR . 52.6 tp -72.42 142.33 48.67 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.202 -0.454 . . . . 75.530000000000001 111.183 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.02 106.72 15.89 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.259 0.552 . . . . 74.329999999999998 111.475 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -74.79 74.87 2.1 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.72 -0.673 . . . . 74.109999999999999 111.568 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -94.67 154.43 17.33 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.967 0.413 . . . . 65.540000000000006 112.009 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.3 170.47 16.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.005 0.431 . . . . 63.450000000000003 111.671 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -67.75 129.95 41.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.043 0.449 . . . . 62.340000000000003 111.687 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.567 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 90.3 m-20 69.42 18.31 7.91 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.604 0.762 . . . . 64.109999999999999 113.028 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.38 132.66 52.2 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.193 -0.317 . . . . 73.120000000000005 110.958 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.1 mtm180 -76.36 118.67 19.3 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.025 0.44 . . . . 65.319999999999993 111.932 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.563 HG12 HD23 ' A' ' 107' ' ' LEU . 34.0 m -124.75 161.38 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.999 -0.546 . . . . 71.519999999999996 111.489 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -138.49 147.23 42.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.125 0.488 . . . . 72.209999999999994 110.311 171.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.9 mt -97.81 137.49 36.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.308 -0.405 . . . . 60.039999999999999 112.035 -173.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.5 mm -63.57 -71.16 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 CA-C-N 116.12 -0.491 . . . . 75.209999999999994 111.413 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.477 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 92.4 m-20 -122.75 82.96 48.95 Favored Pre-proline 0 N--CA 1.473 0.694 0 CA-C-O 120.667 0.27 . . . . 64.230000000000004 111.438 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -82.43 132.2 6.81 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.977 2.451 . . . . 73.439999999999998 113.574 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.5 pt -136.91 125.71 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 120.858 0.361 . . . . 73.129999999999995 111.492 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.02 114.11 18.68 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.302 -0.259 . . . . 41.210000000000001 110.302 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 121.604 0.716 . . . . 60.100000000000001 112.495 -170.489 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 . . . . . 0 CA--C 1.543 0.682 0 CA-C-O 121.253 0.549 . . . . 63.520000000000003 112.329 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -107.48 137.85 44.77 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.622 0.725 . . . . 65.030000000000001 112.318 -171.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 52.7 mt -126.68 109.16 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.567 -0.742 . . . . 71.540000000000006 110.716 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -82.73 129.2 34.93 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 122.138 -0.351 . . . . 73.540000000000006 110.493 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.9 167.39 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.289 0.566 . . . . 61.520000000000003 112.355 -174.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.477 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 31.3 t70 -86.68 -62.04 1.6 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.763 -0.653 . . . . 64.420000000000002 111.235 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -145.59 155.03 42.79 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.127 0.489 . . . . 71.019999999999996 111.122 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 71.0 mt -111.81 115.07 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 115.734 -0.666 . . . . 60.420000000000002 111.577 -178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.32 172.23 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 120.549 0.214 . . . . 65.25 111.055 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.563 HD23 HG12 ' A' ' 76' ' ' VAL . 96.2 mt -83.15 150.0 26.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 122.284 -0.26 . . . . 74.319999999999993 110.892 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.1 m . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 120.762 0.315 . . . . 75.400000000000006 111.345 -179.233 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 57' ' ' ILE . 55.4 mt . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 120.957 0.408 . . . . 64.5 111.965 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.578 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 11.1 mptt -116.62 115.67 26.14 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.855 0.36 . . . . 71.299999999999997 111.506 178.092 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.402 ' HA ' HD23 ' A' ' 48' ' ' LEU . 91.1 t80 -66.8 126.77 30.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.231 -0.44 . . . . 72.439999999999998 111.154 177.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.559 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 82.0 p -106.83 -63.51 1.27 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.949 0.351 . . . . 72.400000000000006 111.949 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.92 176.61 12.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.345 0.593 . . . . 52.100000000000001 112.087 -177.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.44 HD21 ' HG3' ' A' ' 27' ' ' GLU . 61.1 tp -83.16 117.81 23.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.985 -0.552 . . . . 65.310000000000002 111.101 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -69.07 -66.81 0.53 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.939 0.399 . . . . 75.439999999999998 111.363 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -168.25 131.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.061 0.458 . . . . 73.120000000000005 111.745 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.44 ' HG3' HD21 ' A' ' 24' ' ' LEU . 47.2 mt-10 -96.8 99.37 10.95 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.315 -0.402 . . . . 64.530000000000001 110.058 173.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m -74.34 118.98 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.281 0.562 . . . . 73.25 111.516 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.638 ' HG2' HG12 ' A' ' 41' ' ' ILE . 96.3 mtt180 -96.54 164.36 12.64 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.443 0.64 . . . . 71.5 112.291 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.88 111.19 13.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 115.793 -0.64 . . . . 71.530000000000001 111.041 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.5 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 61.6 tt0 -82.75 147.11 28.62 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.053 0.454 . . . . 75.129999999999995 111.617 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -90.93 166.94 12.78 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.924 0.392 . . . . 64.230000000000004 110.477 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.39 -24.73 57.25 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 122.131 -0.356 . . . . 74.530000000000001 111.678 -178.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -80.91 32.27 0.32 Allowed 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 111.965 0.357 . . . . 71.239999999999995 111.965 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.45 -48.08 3.75 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 114.182 0.433 . . . . 71.209999999999994 114.182 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 m -66.79 145.3 55.65 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.236 0.541 . . . . 72.150000000000006 112.428 -177.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.5 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.5 t -96.29 140.65 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.018 -0.537 . . . . 75.319999999999993 111.161 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -75.65 171.68 13.9 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.313 0.578 . . . . 71.340000000000003 111.293 178.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.3 -18.3 32.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 53.140000000000001 110.707 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.38 137.62 57.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.624 -0.716 . . . . 55.119999999999997 110.603 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.638 HG12 ' HG2' ' A' ' 29' ' ' ARG . 32.4 mt -104.46 142.57 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 121.179 0.514 . . . . 75.439999999999998 111.377 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.55 -57.78 2.38 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.274 -0.421 . . . . 72.329999999999998 111.043 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' OG ' ' A' ' 60' ' ' SER . 61.7 mt-10 -137.46 148.48 46.13 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 120.992 0.425 . . . . 73.219999999999999 111.688 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -110.2 111.58 23.0 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.357 -0.383 . . . . 73.140000000000001 111.166 176.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.4 m -101.46 124.16 46.69 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.393 0.516 . . . . 72.150000000000006 112.393 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.2 m-85 -115.83 160.58 19.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.905 0.482 . . . . 72.310000000000002 111.045 177.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -101.12 125.61 47.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.714 0.292 . . . . 43.399999999999999 111.67 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.57 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -123.52 134.37 53.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-O 120.795 0.331 . . . . 71.109999999999999 111.722 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HE2' ' HB3' ' A' ' 22' ' ' SER . 3.8 mptp? -80.77 147.25 30.59 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.98 0.419 . . . . 74.230000000000004 111.313 173.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 116.083 -0.508 . . . . 72.420000000000002 110.507 174.234 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 55' ' ' ARG . 5.3 ptp180 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 120.975 0.417 . . . . 72.510000000000005 111.933 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 43.1 ttm -96.88 110.43 22.94 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.133 -0.485 . . . . 74.109999999999999 109.701 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.432 HD11 HD13 ' A' ' 19' ' ' LEU . 26.8 pt -95.1 127.97 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 121.026 0.441 . . . . 73.140000000000001 111.176 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.448 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 77.3 mt-30 -93.65 105.82 17.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.378 0.608 . . . . 71.030000000000001 110.656 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.57 HG21 HD12 ' A' ' 48' ' ' LEU . 84.0 t -94.82 122.53 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 115.988 -0.551 . . . . 74.549999999999997 111.986 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.729 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 24.5 t -114.35 130.21 56.67 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.968 0.413 . . . . 75.340000000000003 111.377 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 pt -120.36 156.2 55.54 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 116.315 -0.402 . . . . 71.549999999999997 110.982 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.35 125.75 19.44 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.452 2.101 . . . . 61.310000000000002 112.392 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.5 39.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.016 0.747 . . . . 73.409999999999997 113.016 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.0 t -56.82 -30.76 64.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.058 0.456 . . . . 54.130000000000003 111.519 175.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.4 t -78.75 133.88 61.75 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 116.069 -0.514 . . . . 72.239999999999995 111.328 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.49 158.01 4.41 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.379 2.719 . . . . 75.519999999999996 114.476 -178.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.447 HD12 ' OH ' ' A' ' 46' ' ' TYR . 58.6 tp -68.14 145.81 54.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.254 -0.885 . . . . 61.549999999999997 111.767 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -90.12 126.03 35.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.254 0.549 . . . . 63.420000000000002 111.88 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -107.65 25.78 11.09 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.661 -0.7 . . . . 73.219999999999999 111.592 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -62.19 153.45 30.3 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.208 0.528 . . . . 75.209999999999994 112.087 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -80.97 164.71 22.35 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.894 -0.594 . . . . 33.119999999999997 112.267 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -59.12 118.08 5.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.065 -0.516 . . . . 71.450000000000003 111.614 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 68.31 24.25 7.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.55 0.74 . . . . 73.420000000000002 112.216 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.79 133.92 50.06 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.765 0.317 . . . . 73.530000000000001 111.3 176.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.578 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 75.5 mtm180 -74.63 113.49 11.95 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.116 0.484 . . . . 73.329999999999998 111.682 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.16 153.99 35.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.284 0.564 . . . . 73.310000000000002 111.999 -177.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.4 pt-20 -128.01 154.72 45.31 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.126 -0.488 . . . . 72.129999999999995 110.268 173.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.35 146.67 24.54 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.168 0.803 . . . . 71.409999999999997 113.168 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.72 112.49 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 115.336 -0.847 . . . . 62.399999999999999 110.036 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 58.78 62.01 4.59 Favored Pre-proline 0 CA--C 1.547 0.864 0 N-CA-C 112.023 0.379 . . . . 62.140000000000001 112.023 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -81.66 140.45 11.75 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.817 2.345 . . . . 75.099999999999994 113.8 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.44 147.23 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-O 120.945 0.402 . . . . 55.549999999999997 111.099 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.35 108.16 16.35 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.916 0.389 . . . . 72.030000000000001 110.693 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 121.214 0.53 . . . . 61.25 111.564 -174.851 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.244 0.789 0 N-CA-C 114.352 1.241 . . . . 74.129999999999995 114.352 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.448 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -104.39 120.75 41.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.406 -1.27 . . . . 75.129999999999995 111.818 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.489 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 56.4 mt -99.59 107.18 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 109.968 175.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.729 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 58.7 mtpt -94.06 129.14 40.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.15 0.5 . . . . 73.329999999999998 111.942 -175.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.48 174.7 7.62 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.991 0.425 . . . . 71.420000000000002 111.467 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.23 -37.05 26.56 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.952 0.406 . . . . 71.200000000000003 110.787 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -161.01 164.93 30.6 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 116.316 -0.402 . . . . 73.319999999999993 111.502 177.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 44.2 mt -122.56 118.39 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 116.494 -0.321 . . . . 73.349999999999994 110.815 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.38 167.13 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 120.793 0.33 . . . . 74.109999999999999 111.652 -177.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -70.74 144.13 51.03 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.649 0.262 . . . . 71.230000000000004 111.123 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.414 ' HA ' ' HG2' ' A' ' 77' ' ' GLU . 57.8 m . . . . . 0 N--CA 1.473 0.689 0 CA-C-O 120.837 0.351 . . . . 64.010000000000005 111.881 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 CA--C 1.533 0.321 0 CA-C-O 120.813 0.34 . . . . 75.310000000000002 110.174 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 56.9 mtmt -123.71 117.22 24.45 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.258 0.551 . . . . 72.299999999999997 111.978 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.7 157.46 9.35 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.948 -1.024 . . . . 73.109999999999999 113.03 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.48 ' OG ' ' HE3' ' A' ' 49' ' ' LYS . 33.9 m -134.14 -65.22 0.66 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.208 0.448 . . . . 63.219999999999999 112.208 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.52 -179.29 7.53 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.222 0.534 . . . . 42.109999999999999 112.307 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.437 HD21 ' HG3' ' A' ' 27' ' ' GLU . 59.0 tp -88.29 120.08 29.32 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.833 -0.621 . . . . 40.5 110.308 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -76.37 -55.31 5.66 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.982 0.42 . . . . 74.420000000000002 111.421 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -173.57 131.74 0.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.141 -0.482 . . . . 75.420000000000002 111.003 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG3' HD21 ' A' ' 24' ' ' LEU . 37.7 mt-10 -90.83 98.63 11.89 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.721 -0.474 . . . . 60.420000000000002 109.721 171.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.4 m -67.27 119.22 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.33 0.586 . . . . 74.439999999999998 111.284 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.519 ' HG2' HG12 ' A' ' 41' ' ' ILE . 56.5 mtt180 -98.48 167.91 10.52 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.378 0.609 . . . . 63.409999999999997 112.081 -175.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -83.07 100.22 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.842 -0.617 . . . . 74.239999999999995 112.041 -172.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 60.9 tt0 -79.41 120.74 24.26 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.482 -0.326 . . . . 75.340000000000003 110.961 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -67.46 153.34 43.91 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.379 0.511 . . . . 75.209999999999994 112.379 -174.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.02 -32.37 67.89 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.565 0.697 . . . . 61.140000000000001 110.702 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.24 -27.77 66.08 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.225 -0.898 . . . . 62.109999999999999 112.002 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.55 -42.15 1.52 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 121.383 -0.437 . . . . 73.439999999999998 112.737 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -75.85 151.62 37.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.063 0.459 . . . . 74.140000000000001 111.702 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 36.9 t -88.13 136.86 22.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.411 -0.359 . . . . 72.109999999999999 111.414 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t -84.83 149.89 25.4 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.765 0.317 . . . . 63.43 110.539 174.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.05 -14.79 61.48 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.131 0.419 . . . . 33.530000000000001 112.131 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.28 142.2 58.5 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.936 0.398 . . . . 64.140000000000001 111.333 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.519 HG12 ' HG2' ' A' ' 29' ' ' ARG . 43.9 mt -100.58 139.07 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.501 -0.318 . . . . 75.109999999999999 110.696 -178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.61 -58.29 2.23 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.776 0.322 . . . . 74.129999999999995 111.121 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.42 159.38 42.29 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.135 0.493 . . . . 73.109999999999999 111.505 177.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 37.2 mtt-85 -115.62 116.89 28.89 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.264 -0.425 . . . . 62.520000000000003 110.67 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 m -92.49 129.09 38.52 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.655 0.243 . . . . 44.329999999999998 111.655 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.468 ' OH ' HD12 ' A' ' 67' ' ' LEU . 49.6 m-85 -116.77 156.52 27.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.679 0.392 . . . . 72.420000000000002 111.442 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -100.18 112.78 25.1 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.166 -0.47 . . . . 75.329999999999998 111.061 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 59' ' ' VAL . 42.2 mt -114.93 149.01 37.93 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 122.292 -0.255 . . . . 74.540000000000006 110.788 177.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.543 ' HB2' ' NZ ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -103.83 141.55 35.93 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 122.043 -0.411 . . . . 73.420000000000002 111.469 173.191 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.469 0.486 0 CA-C-N 116.073 -0.512 . . . . 72.230000000000004 110.743 176.596 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 112.282 0.475 . . . . 73.439999999999998 112.282 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.566 ' N ' ' SD ' ' A' ' 56' ' ' MET . 1.2 mpt? -79.13 157.94 27.84 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.319 0.859 . . . . 73.329999999999998 113.319 -173.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.1 pt -142.03 135.02 28.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.01 -0.995 . . . . 64.140000000000001 109.586 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.446 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 24.0 mp0 -93.15 104.35 16.55 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.159 0.504 . . . . 72.540000000000006 111.574 -178.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -96.94 130.02 46.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 116.378 -0.373 . . . . 54.100000000000001 111.419 -177.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m -119.15 129.26 54.92 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.682 0.277 . . . . 71.109999999999999 111.434 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.403 HG12 ' HE1' ' A' ' 46' ' ' TYR . 25.9 pt -123.23 149.6 57.99 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.584 -0.28 . . . . 63.409999999999997 110.575 176.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.73 139.62 39.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.557 2.171 . . . . 71.25 113.226 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.2 -26.32 67.64 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 112.585 0.587 . . . . 73.019999999999996 112.585 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.4 t -63.8 -30.28 71.39 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.03 0.443 . . . . 64.400000000000006 111.3 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.0 t -72.18 130.41 86.38 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.216 -0.447 . . . . 72.239999999999995 110.708 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -43.66 131.88 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 123.175 2.584 . . . . 74.150000000000006 114.323 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.468 HD12 ' OH ' ' A' ' 46' ' ' TYR . 62.0 tp -58.37 137.68 57.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.996 -0.547 . . . . 72.310000000000002 111.201 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -75.05 125.95 30.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.198 0.523 . . . . 73.329999999999998 111.255 177.093 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -118.01 22.43 12.24 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.849 -0.614 . . . . 61.43 111.384 -175.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.419 ' CE2' ' HG3' ' A' ' 68' ' ' LYS . 26.0 m-85 -69.34 172.29 7.31 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.522 0.564 . . . . 64.409999999999997 112.522 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.43 174.93 8.66 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.879 -0.6 . . . . 72.319999999999993 111.576 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -74.21 135.66 42.76 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 110.012 -0.366 . . . . 61.219999999999999 110.012 176.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 95.0 m-20 60.56 20.97 10.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.799 0.44 . . . . 74.549999999999997 112.105 -174.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . -68.13 139.9 56.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.926 0.393 . . . . 70.099999999999994 111.663 178.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.601 HH11 ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -68.1 111.13 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.073 -0.512 . . . . 74.209999999999994 111.145 179.342 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.9 m -129.41 147.92 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.362 0.601 . . . . 74.25 112.133 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -133.16 151.2 51.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.025 -0.534 . . . . 72.299999999999997 110.727 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -99.95 135.48 41.32 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.301 -0.409 . . . . 63.140000000000001 111.768 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.442 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.8 mp -67.77 -76.01 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.386 -0.37 . . . . 63.439999999999998 111.061 177.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -126.7 85.36 60.8 Favored Pre-proline 0 N--CA 1.472 0.648 0 CA-C-O 120.754 0.312 . . . . 73.450000000000003 110.951 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.27 156.19 14.63 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 123.219 2.613 . . . . 50.329999999999998 114.469 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.4 pt -142.81 123.11 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.82 -0.627 . . . . 75.540000000000006 110.32 171.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.0 126.88 30.87 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.354 -0.216 . . . . 64.150000000000006 110.929 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 CA--C 1.538 0.492 0 CA-C-O 121.193 0.52 . . . . 62.420000000000002 111.271 -179.433 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 121.984 0.897 . . . . 65.209999999999994 113.309 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 37.6 m-85 -106.57 149.49 27.11 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.861 -1.063 . . . . 74.109999999999999 111.683 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.3 mt -130.37 108.02 15.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 116.227 -0.442 . . . . 74.129999999999995 110.311 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -77.99 129.25 35.06 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 122.295 -0.253 . . . . 72.140000000000001 111.139 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -130.65 151.71 50.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.29 0.478 . . . . 73.0 112.29 -176.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.1 -39.88 93.98 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.18 -0.464 . . . . 63.140000000000001 111.436 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -172.39 162.3 5.38 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.207 -0.451 . . . . 73.219999999999999 111.092 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.412 HG12 ' CD2' ' A' ' 78' ' ' LEU . 31.2 mt -122.42 117.43 52.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 115.938 -0.573 . . . . 72.530000000000001 110.839 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.9 m -122.34 -179.33 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.21 0.204 . . . . 74.200000000000003 111.232 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 88.4 mt -77.85 147.55 35.09 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 120.952 0.406 . . . . 74.299999999999997 111.943 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 112.358 0.503 . . . . 32.329999999999998 112.358 -177.254 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 N--CA 1.469 0.506 0 CA-C-O 121.344 0.592 . . . . 75.310000000000002 112.263 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.569 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 47.4 mmtm -123.97 121.86 36.4 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 55.310000000000002 111.456 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -66.75 102.04 0.89 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.818 0.342 . . . . 74.200000000000003 110.581 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 21.9 t -89.61 -63.59 1.26 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 111.972 0.36 . . . . 60.210000000000001 111.972 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.29 -178.52 7.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.288 0.477 . . . . 62.109999999999999 112.288 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.6 tp -89.35 118.03 28.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.941 0.4 . . . . 62.149999999999999 110.896 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.8 -64.48 1.03 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.958 0.409 . . . . 75.409999999999997 111.748 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -164.71 136.85 4.52 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.36 -0.382 . . . . 75.219999999999999 111.335 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -97.9 101.46 12.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.803 0.335 . . . . 74.430000000000007 110.243 173.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' HB2' ' A' ' 42' ' ' LYS . 18.3 m -72.2 98.75 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 121.657 0.741 . . . . 64.140000000000001 111.327 -178.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 41' ' ' ILE . 85.6 mtt-85 -89.64 155.66 19.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.881 -0.6 . . . . 70.310000000000002 111.611 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.595 HG12 ' HE3' ' A' ' 42' ' ' LYS . 56.7 mt -68.85 106.66 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.995 -0.548 . . . . 71.340000000000003 111.258 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -85.61 123.93 31.58 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.839 0.352 . . . . 73.109999999999999 110.925 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -66.35 157.19 32.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.31 -0.405 . . . . 74.219999999999999 111.714 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -62.46 -25.84 68.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.077 0.465 . . . . 75.400000000000006 110.99 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -63.87 -15.84 59.92 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 116.021 -0.536 . . . . 74.400000000000006 111.611 175.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 -18.46 40.91 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.399 -0.364 . . . . 44.210000000000001 112.866 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.4 p -77.8 157.49 29.93 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.14 0.495 . . . . 70.430000000000007 111.876 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.0 t -102.4 134.85 42.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.459 -0.337 . . . . 73.540000000000006 111.28 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.4 t -90.77 155.3 18.89 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.833 0.349 . . . . 62.119999999999997 111.701 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.36 -30.51 69.6 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.161 0.505 . . . . 75.239999999999995 110.686 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.23 138.91 57.42 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.49 -0.777 . . . . 72.200000000000003 111.799 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.631 HG12 ' HG2' ' A' ' 29' ' ' ARG . 53.1 mt -115.9 138.17 47.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.943 0.401 . . . . 73.409999999999997 111.983 -175.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' HE3' HG12 ' A' ' 30' ' ' ILE . 32.8 mmtp -72.67 -57.18 4.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.444 0.64 . . . . 73.439999999999998 110.205 171.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HB3' ' HA ' ' A' ' 62' ' ' PRO . 8.9 pt-20 -163.92 166.15 21.99 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.489 -0.778 . . . . 60.240000000000002 111.563 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.531 HH12 ' HB2' ' A' ' 67' ' ' LEU . 31.2 mtp180 -114.3 118.34 33.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.464 -0.334 . . . . 74.439999999999998 111.5 -172.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 21.8 m -92.87 131.04 38.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 111.827 0.306 . . . . 71.120000000000005 111.827 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -120.48 143.78 48.35 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.01 0.433 . . . . 71.099999999999994 111.88 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -75.12 109.31 8.5 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.927 -0.579 . . . . 61.240000000000002 110.496 173.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.467 HD12 HG21 ' A' ' 59' ' ' VAL . 41.0 mt -111.93 131.99 55.03 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.354 0.597 . . . . 51.329999999999998 111.808 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.6 mmtm -96.07 136.42 36.54 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.947 -0.569 . . . . 55.240000000000002 110.41 176.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 N--CA 1.476 0.846 0 O-C-N 122.055 -0.403 . . . . 72.329999999999998 111.425 178.326 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 . . . . . 0 N--CA 1.471 0.624 0 CA-C-O 121.572 0.701 . . . . 75.400000000000006 112.808 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 70.5 mtp -93.14 137.43 32.49 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.245 -0.889 . . . . 72.239999999999995 110.725 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.409 HG22 ' NE1' ' A' ' 98' ' ' TRP . 40.0 pt -121.64 138.71 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 120.956 0.407 . . . . 70.400000000000006 111.114 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.7 106.41 18.72 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.519 -0.309 . . . . 72.230000000000004 111.395 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 95.7 t -105.24 128.76 58.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.441 0.534 . . . . 74.239999999999995 112.441 -176.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -113.67 132.5 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.177 -0.465 . . . . 64.400000000000006 111.645 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -110.92 136.38 20.77 Favored Pre-proline 0 N--CA 1.474 0.764 0 CA-C-O 120.522 0.201 . . . . 65.040000000000006 111.073 175.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 33.3 Cg_endo -62.28 158.44 40.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.752 2.301 . . . . 72.120000000000005 113.33 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.99 -16.65 5.15 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.823 0.675 . . . . 72.340000000000003 112.823 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -68.86 -10.23 55.84 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.159 0.429 . . . . 45.210000000000001 112.159 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 44.8 t -108.82 129.75 23.57 Favored Pre-proline 0 CA--C 1.544 0.716 0 N-CA-C 112.261 0.467 . . . . 63.240000000000002 112.261 -176.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 28.9 Cg_exo -64.74 161.68 34.9 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.742 2.295 . . . . 70.25 113.072 174.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.531 ' HB2' HH12 ' A' ' 44' ' ' ARG . 62.7 tp -67.93 134.58 51.03 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.056 0.455 . . . . 74.349999999999994 112.103 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.91 108.64 17.02 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.291 -0.413 . . . . 75.329999999999998 111.027 174.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.75 78.67 9.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.049 0.452 . . . . 65.420000000000002 110.897 176.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -112.86 150.81 31.21 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.96 0.409 . . . . 63.310000000000002 111.2 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -77.34 171.16 15.31 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.327 0.584 . . . . 63.109999999999999 111.734 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -59.39 124.37 19.8 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.178 0.513 . . . . 35.119999999999997 111.917 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.427 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 94.4 m-20 63.36 35.42 12.28 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.731 -0.668 . . . . 65.430000000000007 112.135 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.86 137.36 57.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.367 . . . . 52.100000000000001 111.803 177.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.569 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 58.3 mtp180 -67.83 97.06 0.62 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.251 -0.431 . . . . 74.430000000000007 112.057 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 107' ' ' LEU . 33.9 m -122.04 176.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 121.325 0.583 . . . . 42.350000000000001 112.527 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -159.38 179.58 8.83 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.784 -0.644 . . . . 71.230000000000004 110.448 175.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.486 HD11 HG21 ' A' ' 59' ' ' VAL . 85.5 mt -115.45 149.44 38.03 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.579 0.585 . . . . 73.299999999999997 112.579 -173.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 48.7 mm -83.21 -73.16 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.893 -0.594 . . . . 70.200000000000003 111.094 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.48 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 23.1 m120 -121.35 87.11 44.44 Favored Pre-proline 0 N--CA 1.477 0.885 0 O-C-N 122.244 -0.285 . . . . 72.349999999999994 111.527 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.01 136.04 9.0 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 122.928 2.419 . . . . 74.349999999999994 113.577 175.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 101' ' ' LYS . 35.8 pt -128.65 134.72 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 121.037 0.446 . . . . 71.040000000000006 111.399 172.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.56 111.93 15.11 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.45 -0.341 . . . . 61.109999999999999 110.11 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 t0 . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 121.123 0.487 . . . . 74.329999999999998 111.882 -172.215 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.409 ' NE1' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.646 0 N-CA-C 114.192 1.182 . . . . 75.319999999999993 114.192 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -103.51 116.62 32.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.231 -0.895 . . . . 73.430000000000007 111.902 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.566 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 35.7 mt -105.73 104.42 16.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.353 -0.84 . . . . 64.099999999999994 110.692 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 82' ' ' ILE . 4.7 mtpm? -86.6 121.83 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 122.106 -0.371 . . . . 73.120000000000005 110.204 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.46 161.46 19.55 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.321 0.86 . . . . 61.420000000000002 113.321 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 21.5 t70 -63.91 -55.18 24.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.327 -0.851 . . . . 72.549999999999997 111.652 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -158.09 159.11 35.92 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.963 0.411 . . . . 73.109999999999999 111.364 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.48 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 57.0 mt -116.71 121.7 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.081 -0.509 . . . . 63.439999999999998 111.15 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 30.8 m -124.36 -179.13 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.401 -0.363 . . . . 74.439999999999998 110.832 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.437 ' HA ' ' HA ' ' A' ' 76' ' ' VAL . 93.9 mt -80.86 151.22 28.77 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.091 -0.381 . . . . 70.510000000000005 111.327 177.368 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 112.259 0.466 . . . . 73.409999999999997 112.259 -176.048 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 69.8 mt . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.543 0.211 . . . . 73.219999999999999 110.743 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 90.2 mttt -126.66 127.37 45.07 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.094 0.474 . . . . 73.450000000000003 112.157 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -67.35 136.06 54.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.88 -0.6 . . . . 74.310000000000002 111.532 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.2 p -113.51 -63.51 1.44 Allowed 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.989 -0.445 . . . . 73.0 111.229 174.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.78 -173.95 4.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.077 0.465 . . . . 52.43 111.759 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 60.4 tp -92.7 124.43 36.71 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.469 -0.332 . . . . 73.430000000000007 110.764 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 25' ' ' ARG . 4.1 tpp180 -75.84 -58.1 3.48 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.864 0.364 . . . . 73.430000000000007 111.942 -177.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -168.55 141.14 2.88 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.024 0.44 . . . . 72.340000000000003 111.817 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.9 mt-10 -101.2 98.36 8.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.714 -0.476 . . . . 75.310000000000002 109.714 171.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 m -70.15 110.8 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.356 0.598 . . . . 74.519999999999996 110.209 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 81.7 mtt180 -100.34 156.32 17.31 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.513 0.56 . . . . 73.409999999999997 112.513 -171.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.73 115.43 2.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.733 -0.667 . . . . 63.340000000000003 111.844 -174.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -88.67 119.17 28.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.278 -0.419 . . . . 73.450000000000003 110.92 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -60.59 159.91 9.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.062 0.458 . . . . 73.120000000000005 111.619 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.76 -18.03 52.37 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.098 -0.501 . . . . 71.450000000000003 111.905 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -83.36 -0.11 48.35 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.185 0.439 . . . . 70.510000000000005 112.185 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -11.22 70.72 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.169 -0.539 . . . . 75.450000000000003 113.726 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -86.98 152.19 22.61 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.418 -0.46 . . . . 60.100000000000001 111.606 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.4 t -95.04 125.62 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 120.952 0.406 . . . . 60.340000000000003 111.455 -178.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -79.73 176.39 9.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.355 0.598 . . . . 54.329999999999998 111.973 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -83.68 -23.41 31.73 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.029 -0.532 . . . . 74.310000000000002 111.208 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.61 143.7 54.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.895 0.379 . . . . 74.230000000000004 111.11 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.505 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.1 mt -101.14 141.56 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 121.045 0.45 . . . . 60.549999999999997 112.16 -174.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -82.53 -50.86 8.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.396 0.617 . . . . 72.120000000000005 109.903 174.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -165.98 159.94 16.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.426 -0.806 . . . . 51.109999999999999 110.982 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.8 mtt180 -107.58 123.59 48.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.073 0.397 . . . . 72.230000000000004 112.073 -175.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.5 m -96.24 114.07 25.72 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.739 0.304 . . . . 74.129999999999995 111.382 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -101.04 156.16 17.57 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.959 0.409 . . . . 71.5 111.762 178.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.543 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 26.8 m-20 -97.65 116.78 30.52 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.033 -0.53 . . . . 72.549999999999997 111.827 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.508 HD12 HG21 ' A' ' 59' ' ' VAL . 66.9 mt -118.86 126.77 52.56 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.05 0.453 . . . . 73.129999999999995 111.003 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HD2' ' HG3' ' A' ' 56' ' ' MET . 0.5 OUTLIER -104.74 115.49 30.41 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.978 0.418 . . . . 72.010000000000005 111.272 178.603 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.902 0.382 . . . . 65.140000000000001 110.805 178.002 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.293 0.568 . . . . 75.430000000000007 112.319 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.562 ' HG3' ' HD2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -94.98 133.3 38.89 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.69 -0.686 . . . . 64.120000000000005 111.616 178.681 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.7 pt -126.3 141.53 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 120.636 0.255 . . . . 74.450000000000003 111.084 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -105.19 111.36 24.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.032 0.444 . . . . 75.140000000000001 110.844 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 48' ' ' LEU . 92.7 t -101.98 137.59 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.385 -0.37 . . . . 62.43 111.446 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 89.0 p -124.65 128.81 49.43 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.292 0.568 . . . . 61.219999999999999 112.048 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.499 HG21 HG13 ' A' ' 105' ' ' ILE . 29.0 pt -118.91 153.92 52.84 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 115.829 -0.623 . . . . 72.109999999999999 110.69 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.43 153.28 55.29 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.406 2.071 . . . . 72.109999999999999 113.399 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -16.92 60.17 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.152 0.427 . . . . 71.340000000000003 112.152 -178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 74.5 p -66.27 -18.8 65.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.841 0.353 . . . . 75.329999999999998 111.601 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.37 124.32 53.8 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 116.562 -0.29 . . . . 74.200000000000003 111.303 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.37 169.29 18.76 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.0 2.467 . . . . 61.109999999999999 114.141 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.0 tp -70.85 128.82 37.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.908 -0.587 . . . . 73.319999999999993 111.513 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.41 114.72 23.41 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.262 0.553 . . . . 71.319999999999993 112.294 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.96 51.91 1.42 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.716 -0.674 . . . . 61.200000000000003 111.205 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -76.71 159.03 30.53 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.325 0.584 . . . . 75.109999999999999 112.108 -177.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -77.03 148.26 36.29 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.886 -0.597 . . . . 63.0 111.334 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -59.85 119.27 7.38 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.87 0.367 . . . . 74.409999999999997 111.521 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.476 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 5.2 m-20 71.99 24.83 3.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.319 0.648 . . . . 72.310000000000002 112.387 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.97 137.3 43.44 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.549 -0.296 . . . . 52.310000000000002 110.577 171.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 19' ' ' LEU . 76.2 mtm-85 -66.85 126.62 29.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.75 0.31 . . . . 74.120000000000005 111.44 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.549 HG12 HD23 ' A' ' 107' ' ' LEU . 27.1 m -129.13 151.53 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 121.285 0.564 . . . . 60.310000000000002 112.328 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.67 157.86 43.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.182 -0.463 . . . . 73.040000000000006 110.445 174.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.8 mt -106.02 141.87 36.68 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.093 0.775 . . . . 74.230000000000004 113.093 -170.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.417 ' HB ' ' HB3' ' A' ' 104' ' ' ASP . 38.8 mm -97.22 118.17 43.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.619 -0.718 . . . . 72.400000000000006 110.115 174.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.4 m120 61.55 58.33 3.15 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 123.154 0.581 . . . . 71.120000000000005 111.962 -173.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -81.82 132.52 7.6 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.753 2.302 . . . . 73.310000000000002 113.745 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.1 pt -139.36 142.22 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-O 120.764 0.316 . . . . 74.530000000000001 111.241 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.03 123.16 24.67 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.246 -0.284 . . . . 65.219999999999999 110.697 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 t0 . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 121.09 0.471 . . . . 62.219999999999999 111.057 -175.677 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 114.464 1.283 . . . . 62.420000000000002 114.464 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -114.86 144.94 42.74 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.258 -1.337 . . . . 75.209999999999994 111.423 -174.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.494 ' HB ' HG22 ' A' ' 59' ' ' VAL . 61.0 mt -129.65 122.1 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.332 -0.395 . . . . 74.510000000000005 110.97 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -89.27 149.14 23.2 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 122.081 -0.387 . . . . 73.409999999999997 110.702 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.61 161.18 42.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 65.439999999999998 111.496 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.87 -30.93 24.05 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.945 0.402 . . . . 71.439999999999998 110.986 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.417 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 25.3 t0 -161.19 153.94 20.76 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.399 0.619 . . . . 61.210000000000001 112.045 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.499 HG13 HG21 ' A' ' 61' ' ' ILE . 62.0 mt -115.11 114.18 45.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.515 -0.766 . . . . 72.540000000000006 111.178 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.2 m -123.89 178.54 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.834 0.349 . . . . 43.539999999999999 111.599 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.549 HD23 HG12 ' A' ' 76' ' ' VAL . 98.0 mt -85.12 146.33 27.19 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.785 0.326 . . . . 74.310000000000002 111.68 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.805 0.336 . . . . 74.329999999999998 111.152 179.403 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.6 mt . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 110.156 -0.313 . . . . 44.520000000000003 110.156 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.605 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -118.62 139.94 50.71 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.351 0.5 . . . . 73.25 112.351 -177.92 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -77.13 142.6 39.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.926 -0.579 . . . . 62.109999999999999 111.282 176.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 46.3 t -123.72 -62.69 1.28 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.253 -0.431 . . . . 72.299999999999997 111.454 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.63 174.54 15.19 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.127 0.489 . . . . 70.329999999999998 111.858 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.8 tp -87.85 113.43 23.5 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.012 -0.54 . . . . 73.129999999999995 110.984 177.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 25' ' ' ARG . 11.6 tpp85 -61.44 -58.13 9.44 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.744 0.307 . . . . 64.340000000000003 111.443 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -176.71 143.08 0.44 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.413 0.523 . . . . 74.430000000000007 112.413 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -101.21 98.27 8.69 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.29 -0.633 . . . . 65.129999999999995 109.29 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 42' ' ' LYS . 30.0 m -77.46 126.6 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 120.898 0.38 . . . . 62.399999999999999 111.756 -175.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.572 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.5 mtt180 -96.03 158.26 15.52 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.89 0.376 . . . . 71.540000000000006 111.525 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mt -72.3 139.93 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 116.115 -0.493 . . . . 74.200000000000003 111.006 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -107.16 122.71 47.04 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.982 -0.449 . . . . 71.239999999999995 111.359 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -72.17 167.4 20.39 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.299 0.571 . . . . 51.439999999999998 112.22 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.92 -24.75 64.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.969 -0.559 . . . . 63.420000000000002 111.592 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -65.15 -14.06 59.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.002 0.429 . . . . 63.509999999999998 111.932 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.55 -3.24 83.49 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.13 -0.557 . . . . 74.400000000000006 112.535 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -98.3 148.73 23.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.212 0.53 . . . . 74.400000000000006 111.764 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.98 141.93 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.889 -0.596 . . . . 72.140000000000001 111.599 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -90.51 169.61 10.89 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.073 -0.512 . . . . 74.420000000000002 112.205 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -76.73 -26.96 55.22 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.812 -0.631 . . . . 73.140000000000001 110.895 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -77.42 146.21 36.7 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.614 0.721 . . . . 63.439999999999998 111.93 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.0 mt -99.46 144.83 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.591 -0.731 . . . . 73.310000000000002 111.068 -176.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.559 ' HB3' HG23 ' A' ' 28' ' ' VAL . 27.7 tptp -82.91 -57.62 3.22 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.304 -0.407 . . . . 64.530000000000001 111.076 177.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -168.38 160.93 11.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.916 0.388 . . . . 72.219999999999999 111.494 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -107.84 125.96 52.08 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.879 0.371 . . . . 75.310000000000002 111.912 -175.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -107.45 121.19 44.12 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.183 -0.462 . . . . 70.129999999999995 112.145 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.64 152.68 24.47 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.688 0.395 . . . . 75.319999999999993 111.989 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.643 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 11.9 m-20 -97.63 111.66 23.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.709 0.633 . . . . 73.439999999999998 112.709 177.133 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.1 mt -114.65 128.49 56.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.982 -0.553 . . . . 64.049999999999997 110.344 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.643 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 2.4 mptp? -120.29 145.95 46.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.957 0.408 . . . . 71.430000000000007 111.592 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p . . . . . 0 N--CA 1.475 0.782 0 CA-C-N 116.183 -0.462 . . . . 74.030000000000001 110.859 176.674 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt180 . . . . . 0 N--CA 1.468 0.465 0 CA-C-O 121.163 0.506 . . . . 64.439999999999998 111.194 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.9 ptt? -111.37 141.25 45.16 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.077 -0.511 . . . . 63.119999999999997 111.516 -176.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 22.4 pt -133.49 137.32 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.164 -0.471 . . . . 72.030000000000001 111.565 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.07 114.09 26.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.784 0.326 . . . . 73.510000000000005 110.84 175.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 87.7 t -94.97 119.32 42.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.771 0.319 . . . . 62.140000000000001 111.573 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.6 m -108.68 114.76 28.83 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.999 0.428 . . . . 53.130000000000003 111.894 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 pt -108.09 154.09 41.41 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.117 -0.492 . . . . 74.299999999999997 111.079 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.57 146.78 51.74 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.747 2.298 . . . . 60.329999999999998 113.486 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.25 64.72 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.128 0.788 . . . . 72.120000000000005 113.128 -175.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 t -68.99 -19.21 64.14 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.998 0.428 . . . . 73.120000000000005 111.386 177.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.3 t -87.1 127.08 60.68 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.406 -0.361 . . . . 74.140000000000001 110.864 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.5 177.94 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.722 2.281 . . . . 72.230000000000004 113.886 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.0 tp -79.92 126.51 31.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.794 -0.639 . . . . 63.420000000000002 111.894 -175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -80.61 122.85 27.58 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.2 0.524 . . . . 75.420000000000002 111.74 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.31 76.88 1.74 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.129 0.49 . . . . 42.310000000000002 111.075 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -90.04 -172.51 3.53 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.134 0.492 . . . . 73.25 112.126 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -118.11 161.6 19.57 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 116.275 -0.42 . . . . 72.439999999999998 111.384 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.34 124.39 20.78 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.873 0.368 . . . . 70.329999999999998 111.276 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.605 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 41.9 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 112.74 0.645 . . . . 73.209999999999994 112.74 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.66 124.91 25.39 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.302 -0.249 . . . . 31.449999999999999 110.88 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -63.21 122.48 16.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.052 0.453 . . . . 54.329999999999998 111.527 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.473 HG12 HD23 ' A' ' 107' ' ' LEU . 27.6 m -126.14 140.18 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.12 0.486 . . . . 74.400000000000006 111.291 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 108' ' ' THR . 12.7 pt-20 -121.75 152.6 39.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.302 0.572 . . . . 73.109999999999999 111.126 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.6 mt -101.19 145.39 28.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.884 -0.598 . . . . 63.420000000000002 111.378 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -75.48 -70.98 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.561 -0.29 . . . . 74.019999999999996 110.664 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -122.81 86.03 50.01 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-O 120.72 0.295 . . . . 72.420000000000002 111.477 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.55 150.14 14.77 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.976 2.45 . . . . 60.32 113.502 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.1 pt -140.97 132.36 28.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 73.109999999999999 110.637 171.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.96 125.02 28.83 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 116.575 -0.284 . . . . 64.030000000000001 110.96 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 . . . . . 0 CA--C 1.539 0.548 0 CA-C-O 121.148 0.499 . . . . 73.409999999999997 111.105 -177.998 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 8.8 p-90 . . . . . 0 N--CA 1.473 0.7 0 N-CA-C 113.031 0.752 . . . . 73.430000000000007 113.031 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -112.68 140.43 47.45 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.134 0.79 . . . . 65.239999999999995 113.134 -172.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 57.2 mt -123.33 113.46 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.209 -0.905 . . . . 75.329999999999998 110.39 173.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -84.39 136.22 33.96 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.157 -0.339 . . . . 73.010000000000005 110.246 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.94 164.48 30.07 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.263 0.838 . . . . 53.439999999999998 113.263 -173.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.54 -66.65 0.63 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.259 -0.882 . . . . 73.510000000000005 111.183 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -141.37 162.46 35.43 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.084 0.468 . . . . 74.25 111.572 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 37.4 mt -125.87 121.46 59.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.812 -0.631 . . . . 55.109999999999999 110.979 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.1 m -130.99 172.15 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 120.745 0.307 . . . . 71.010000000000005 111.55 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.473 HD23 HG12 ' A' ' 76' ' ' VAL . 92.3 mt -76.74 135.82 39.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.602 0.239 . . . . 71.329999999999998 111.25 177.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.405 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 6.2 m . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 116.512 -0.313 . . . . 70.200000000000003 111.371 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 mt . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.783 0.325 . . . . 70.409999999999997 110.987 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 61.1 mttp -114.31 118.17 33.16 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.093 0.473 . . . . 61.130000000000003 112.082 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.39 115.07 13.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.029 -0.532 . . . . 72.329999999999998 111.391 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.2 p -99.25 -60.87 1.45 Allowed 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.075 0.398 . . . . 63.100000000000001 112.075 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.25 177.88 10.57 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.863 0.69 . . . . 65.200000000000003 112.863 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.3 tp -81.98 119.52 24.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.477 -0.783 . . . . 74.510000000000005 110.604 173.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 8.5 tpt180 -74.89 -55.76 5.46 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.064 0.394 . . . . 72.430000000000007 112.064 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -170.67 143.1 2.11 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.897 0.332 . . . . 72.409999999999997 111.897 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -110.49 118.96 37.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.747 0.308 . . . . 73.299999999999997 110.588 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.9 m -96.73 117.71 41.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 121.021 0.439 . . . . 65.329999999999998 110.619 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.615 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 78.5 mtt180 -91.76 179.52 5.61 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.363 0.601 . . . . 75.219999999999999 112.511 -175.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.0 mt -97.83 114.22 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.633 -0.712 . . . . 64.450000000000003 110.989 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.3 tt0 -81.28 130.2 34.93 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.284 0.564 . . . . 73.219999999999999 111.527 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.453 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.4 m-20 -80.63 145.78 31.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.792 -0.64 . . . . 74.010000000000005 110.682 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -63.36 -18.12 63.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.118 0.485 . . . . 73.329999999999998 111.166 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.35 -17.91 63.09 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.937 -0.574 . . . . 72.430000000000007 111.703 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.01 -49.15 0.89 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.379 -0.439 . . . . 55.240000000000002 113.175 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.5 m -74.45 155.92 37.52 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.067 0.461 . . . . 75.409999999999997 111.638 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 40.4 t -96.39 124.33 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.489 -0.323 . . . . 75.420000000000002 111.314 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.453 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 47.8 t -59.68 164.46 3.62 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.809 0.67 . . . . 54.149999999999999 112.809 -177.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.615 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 10.2 m-20 -81.56 -2.72 51.02 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.963 -0.562 . . . . 74.019999999999996 110.659 171.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.85 124.84 27.59 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.057 -0.52 . . . . 74.099999999999994 109.949 170.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 48.9 mt -95.46 140.88 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.748 0.309 . . . . 73.530000000000001 110.854 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -87.27 -59.55 2.22 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.724 0.297 . . . . 62.219999999999999 110.963 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -137.64 161.05 37.5 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.402 0.62 . . . . 71.519999999999996 111.772 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -132.61 111.24 11.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.68 -0.691 . . . . 65.349999999999994 110.856 -177.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 31.0 m -95.14 131.65 40.92 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.409 0.522 . . . . 74.230000000000004 112.409 -175.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -113.33 152.2 30.22 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.772 0.429 . . . . 72.329999999999998 111.444 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.516 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 48.8 m-20 -88.11 110.11 20.4 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.283 -0.417 . . . . 73.310000000000002 111.217 174.019 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.652 HD12 HG21 ' A' ' 59' ' ' VAL . 41.2 mt -114.53 130.63 56.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.993 0.425 . . . . 62.140000000000001 110.847 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.0 mmtm -87.29 118.03 26.44 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.83 0.348 . . . . 74.340000000000003 110.832 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.323 0.582 . . . . 73.340000000000003 112.399 -176.492 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 120.974 0.416 . . . . 74.450000000000003 111.696 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -70.07 132.75 46.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.038 -0.528 . . . . 51.409999999999997 109.815 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.455 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 34.0 pt -103.48 118.11 50.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.126 0.489 . . . . 62.049999999999997 110.838 177.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -87.4 104.33 16.34 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.097 0.475 . . . . 74.420000000000002 109.741 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.652 HG21 HD12 ' A' ' 48' ' ' LEU . 90.3 t -94.39 119.74 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-O 121.105 0.479 . . . . 74.310000000000002 112.25 -172.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.2 m -106.7 121.97 45.41 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.994 -0.548 . . . . 71.239999999999995 111.29 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.451 HG21 HG13 ' A' ' 105' ' ' ILE . 36.9 pt -119.33 145.91 39.68 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 116.657 -0.247 . . . . 65.409999999999997 110.62 174.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.47 134.64 64.8 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.113 1.875 . . . . 75.209999999999994 112.261 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.76 -7.17 6.99 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.805 0.669 . . . . 65.25 112.805 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.5 p -70.46 -20.06 62.91 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 120.719 0.295 . . . . 51.219999999999999 110.883 173.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.5 t -82.1 133.47 51.07 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.981 -0.554 . . . . 65.209999999999994 110.747 175.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.64 151.19 7.9 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.14 2.56 . . . . 63.439999999999998 114.421 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 68.2 tp -63.96 136.34 57.26 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.926 -0.579 . . . . 73.200000000000003 112.197 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -92.52 125.21 37.06 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.15 0.5 . . . . 45.43 111.339 175.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -113.29 72.01 0.76 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.923 -0.58 . . . . 74.510000000000005 111.007 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -102.87 170.32 8.06 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.412 0.625 . . . . 72.400000000000006 111.856 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.6 168.34 10.59 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.54 -0.755 . . . . 74.310000000000002 111.496 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.23 130.68 44.05 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.912 0.387 . . . . 71.129999999999995 111.851 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.419 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 96.3 m-20 62.12 21.98 12.8 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.225 0.61 . . . . 71.310000000000002 112.222 -177.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.16 127.95 34.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.621 0.248 . . . . 70.120000000000005 111.038 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -62.05 116.26 4.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.125 0.488 . . . . 75.239999999999995 111.593 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 HD23 ' A' ' 107' ' ' LEU . 29.5 m -129.09 152.87 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.073 -0.512 . . . . 73.329999999999998 111.888 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.08 152.55 50.98 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.086 0.469 . . . . 73.120000000000005 110.461 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.0 mt -98.19 144.96 27.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.167 0.803 . . . . 60.109999999999999 113.167 -170.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.6 mm -92.37 113.51 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.378 -0.828 . . . . 75.439999999999998 110.31 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.2 m120 48.3 67.69 4.25 Favored Pre-proline 0 N--CA 1.48 1.041 0 N-CA-C 112.776 0.658 . . . . 71.239999999999995 112.776 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.49 146.27 15.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.869 2.379 . . . . 71.420000000000002 113.429 177.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 46.8 pt -136.81 140.95 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 122.659 0.384 . . . . 72.519999999999996 111.002 176.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.35 124.9 25.31 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.188 -0.32 . . . . 61.32 110.709 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.5 t0 . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 121.469 0.652 . . . . 33.539999999999999 111.25 -175.438 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.455 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 122.309 1.052 . . . . 75.530000000000001 113.681 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -107.08 148.38 28.85 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.741 -1.118 . . . . 65.400000000000006 111.237 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 38.2 mt -123.53 113.54 37.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 110.052 -0.351 . . . . 50.109999999999999 110.052 174.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -85.35 132.64 34.21 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 122.224 -0.297 . . . . 54.439999999999998 110.691 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -127.13 151.14 49.05 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.335 0.494 . . . . 72.530000000000001 112.335 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.16 -31.29 67.51 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.066 -0.515 . . . . 71.540000000000006 110.777 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -167.03 161.26 14.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.015 -0.539 . . . . 75.230000000000004 111.413 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.451 HG13 HG21 ' A' ' 61' ' ' ILE . 42.2 mt -122.83 116.71 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.356 -0.384 . . . . 74.299999999999997 111.174 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.2 m -124.35 171.32 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.903 0.383 . . . . 73.019999999999996 111.478 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.523 HD23 HG12 ' A' ' 76' ' ' VAL . 97.5 mt -75.62 145.34 41.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.479 -0.328 . . . . 63.509999999999998 110.809 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.536 0.439 0 CA-C-O 120.663 0.268 . . . . 61.200000000000003 110.974 177.2 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 92.1 mt . . . . . 0 CA--C 1.535 0.377 0 CA-C-O 120.848 0.356 . . . . 75.420000000000002 110.643 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.495 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 7.1 mtmp? -136.21 140.82 43.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.52 -0.309 . . . . 73.230000000000004 111.305 -176.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -65.4 135.48 55.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.095 0.406 . . . . 73.140000000000001 112.095 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.0 m -116.14 -63.96 1.38 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.835 0.35 . . . . 72.140000000000001 111.428 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.26 -173.68 4.15 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.043 0.449 . . . . 63.549999999999997 111.747 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.6 tp -102.09 127.24 49.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.393 -0.367 . . . . 61.520000000000003 110.177 171.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -79.63 -68.47 0.66 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.969 0.414 . . . . 75.400000000000006 111.951 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -163.42 145.6 9.8 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.275 0.472 . . . . 71.549999999999997 112.275 -171.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -106.67 103.1 12.46 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.286 -0.416 . . . . 62.109999999999999 110.911 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 m -76.6 109.98 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.344 0.592 . . . . 63.32 111.172 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 70.0 mtp180 -92.67 170.43 9.72 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.2 -0.455 . . . . 70.25 111.957 -174.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 40' ' ' GLU . 48.6 mt -80.82 144.18 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.484 -0.325 . . . . 73.219999999999999 111.1 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -110.48 133.25 53.46 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.767 0.318 . . . . 64.450000000000003 111.028 176.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.6 m-20 -79.68 162.43 25.23 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.49 0.552 . . . . 74.030000000000001 112.49 -175.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.89 -38.71 67.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.73 -0.668 . . . . 65.310000000000002 110.869 174.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.25 -37.44 67.22 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.534 -0.757 . . . . 73.409999999999997 111.539 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.25 -32.18 4.99 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 116.061 -0.518 . . . . 60.310000000000002 111.952 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 54.8 m -62.7 166.54 5.33 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.055 0.455 . . . . 75.120000000000005 111.737 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.31 146.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.933 0.397 . . . . 73.140000000000001 111.507 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 32.7 t -94.65 156.62 16.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.093 0.473 . . . . 72.439999999999998 111.508 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.452 ' HA ' ' NH2' ' A' ' 29' ' ' ARG . 13.5 t70 -67.06 -31.56 72.15 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.177 -0.465 . . . . 64.140000000000001 111.043 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.439 ' HB2' HD12 ' A' ' 30' ' ' ILE . 16.9 mm-40 -73.45 152.53 40.73 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.434 0.635 . . . . 73.129999999999995 112.008 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 56.9 mt -114.56 147.17 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.972 -0.558 . . . . 53.329999999999998 111.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.57 -60.51 2.23 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.064 0.459 . . . . 72.519999999999996 111.411 176.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -147.04 167.44 24.06 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.105 -0.498 . . . . 73.349999999999994 111.019 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -128.93 118.21 22.26 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.243 -0.435 . . . . 73.040000000000006 110.739 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.2 m -95.76 124.97 40.02 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.385 0.513 . . . . 72.319999999999993 112.385 -175.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -106.4 167.87 9.54 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.086 0.47 . . . . 72.530000000000001 111.568 177.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -112.38 116.15 29.87 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.78 -0.646 . . . . 74.25 111.031 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -121.6 121.06 36.57 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 73.209999999999994 111.238 178.223 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 56' ' ' MET . 20.2 ptmt -96.45 128.47 43.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.395 0.617 . . . . 62.350000000000001 111.603 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 121.175 0.512 . . . . 65.310000000000002 111.893 -177.354 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 . . . . . 0 N--CA 1.47 0.564 0 CA-C-O 121.097 0.475 . . . . 72.150000000000006 111.582 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.484 ' HA ' ' HA ' ' A' ' 49' ' ' LYS . 22.8 ptp -105.45 144.11 32.68 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.903 -0.59 . . . . 63.5 111.441 176.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 100' ' ' ILE . 24.0 pt -106.06 144.62 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 116.103 -0.499 . . . . 62.140000000000001 110.598 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -87.74 105.43 17.38 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.836 0.35 . . . . 62.530000000000001 111.017 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.47 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -101.1 119.62 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 N-CA-C 112.218 0.451 . . . . 74.319999999999993 112.218 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.538 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 39.2 m -106.79 129.13 54.7 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.989 0.423 . . . . 43.130000000000003 111.623 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.9 pt -126.7 149.85 69.52 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 116.508 -0.315 . . . . 64.409999999999997 110.645 174.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -55.69 141.82 83.54 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.486 2.124 . . . . 73.310000000000002 112.843 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.27 -18.13 34.74 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.59 0.589 . . . . 65.230000000000004 112.59 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 45.1 t -62.38 -27.95 69.43 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.851 0.358 . . . . 63.409999999999997 111.484 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.7 t -77.08 128.58 80.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 116.512 -0.313 . . . . 73.25 111.034 178.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 155.42 33.45 Favored 'Trans proline' 0 CA--C 1.544 1.008 0 C-N-CA 122.797 2.331 . . . . 62.43 113.667 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.52 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 26.7 tp -67.89 134.42 50.82 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.095 -0.502 . . . . 64.430000000000007 111.749 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.414 ' H ' HD12 ' A' ' 67' ' ' LEU . 61.1 mmtt -83.74 -70.99 0.53 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.844 0.683 . . . . 74.329999999999998 112.844 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.52 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 50.6 mt-10 55.6 49.85 15.68 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 120.702 0.287 . . . . 71.430000000000007 111.608 -175.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -66.65 169.56 7.6 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.119 0.485 . . . . 75.230000000000004 112.072 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 3.9 m-20 -60.66 138.3 58.09 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.994 -0.548 . . . . 74.219999999999999 111.061 176.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -62.68 125.31 23.51 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 116.389 -0.369 . . . . 71.010000000000005 111.615 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 69.32 17.63 8.18 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.593 0.757 . . . . 70.209999999999994 112.914 -176.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.541 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -80.21 146.33 31.79 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.991 -0.443 . . . . 71.209999999999994 111.265 175.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 75.4 mtt180 -69.99 114.81 8.52 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.046 0.45 . . . . 74.430000000000007 111.681 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.554 HG12 HD23 ' A' ' 107' ' ' LEU . 27.4 m -126.93 140.42 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.075 -0.511 . . . . 74.329999999999998 111.146 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.7 pt-20 -121.66 155.9 34.16 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.242 0.544 . . . . 74.430000000000007 111.331 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -98.86 122.14 41.72 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.373 0.509 . . . . 60.530000000000001 112.373 -174.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -72.5 108.53 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 115.956 -0.565 . . . . 74.109999999999999 110.331 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 55.57 67.02 3.27 Favored Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 112.817 0.673 . . . . 74.109999999999999 112.817 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.87 137.7 10.03 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.778 2.318 . . . . 63.240000000000002 113.633 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 101' ' ' LYS . 40.1 pt -120.59 141.95 38.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 121.029 0.442 . . . . 73.019999999999996 110.995 174.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.72 129.0 36.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.611 -0.268 . . . . 72.120000000000005 110.468 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.1 t0 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 121.277 0.56 . . . . 74.219999999999999 111.998 -174.825 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.805 0 N-CA-C 113.754 1.02 . . . . 75.450000000000003 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -107.32 143.92 34.91 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.828 -1.078 . . . . 72.109999999999999 111.614 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 57' ' ' ILE . 63.2 mt -131.87 131.68 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.976 -0.556 . . . . 72.439999999999998 110.315 176.094 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.538 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 32.9 mtmm -109.14 126.03 52.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.761 0.315 . . . . 75.099999999999994 111.228 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.76 162.95 16.88 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.5 0.556 . . . . 72.450000000000003 112.5 -173.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -73.27 -29.15 62.54 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.583 -0.735 . . . . 73.400000000000006 110.542 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -174.45 162.63 3.53 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.995 -0.548 . . . . 74.319999999999993 111.266 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 34.2 mt -118.98 119.92 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.44 -0.345 . . . . 71.530000000000001 110.665 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.72 174.13 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-O 120.905 0.384 . . . . 74.219999999999999 111.834 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.554 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -77.53 132.29 38.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.66 -0.246 . . . . 70.400000000000006 111.023 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 87.6 m . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 112.108 0.41 . . . . 73.340000000000003 112.108 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.8 mt . . . . . 0 CA--C 1.532 0.255 0 CA-C-O 120.732 0.301 . . . . 71.349999999999994 110.189 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 73' ' ' ASN . 9.0 mtpm? -101.63 120.88 41.02 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.129 0.49 . . . . 71.349999999999994 111.729 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.482 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 35.7 t80 -59.34 115.21 3.09 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.454 -0.793 . . . . 72.299999999999997 110.371 173.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.479 ' OG ' ' HG2' ' A' ' 49' ' ' LYS . 49.7 m -98.69 -64.42 1.04 Allowed 'General case' 0 N--CA 1.474 0.735 0 O-C-N 122.12 -0.362 . . . . 65.340000000000003 111.958 -178.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.28 176.96 11.12 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.287 0.565 . . . . 52.520000000000003 112.257 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.3 tp -91.25 107.32 19.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.809 -0.632 . . . . 70.019999999999996 110.513 175.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -61.66 -59.2 5.55 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.43 -0.35 . . . . 73.540000000000006 111.7 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -173.26 130.51 0.47 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.508 0.559 . . . . 74.409999999999997 112.508 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -98.58 99.54 10.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.99 -0.55 . . . . 73.420000000000002 110.102 171.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 m -77.71 115.54 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.027 0.442 . . . . 61.5 111.285 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.565 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 78.8 mtt85 -87.29 168.45 13.18 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.265 0.555 . . . . 73.219999999999999 112.153 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.3 mt -79.4 122.15 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 60.200000000000003 111.786 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -91.94 112.59 24.58 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.9 0.381 . . . . 71.120000000000005 111.035 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -59.17 162.88 4.1 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.64 0.608 . . . . 65.120000000000005 112.64 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.35 -32.7 57.46 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 116.171 -0.468 . . . . 65.310000000000002 111.345 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.14 -7.26 22.05 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.493 0.553 . . . . 54.299999999999997 112.493 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 93.33 -10.28 73.42 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.234 -0.508 . . . . 73.239999999999995 113.27 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -93.4 145.41 24.5 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.39 -0.476 . . . . 40.439999999999998 111.518 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 28.9 t -75.49 151.72 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.525 -0.307 . . . . 74.540000000000006 111.521 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -105.1 170.99 7.56 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.09 0.471 . . . . 72.400000000000006 111.679 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.26 -28.25 64.02 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.993 -0.549 . . . . 71.439999999999998 110.945 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -74.96 146.15 41.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.313 0.577 . . . . 71.120000000000005 112.225 -177.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 51.3 mt -99.0 153.63 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 115.655 -0.702 . . . . 74.540000000000006 111.348 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 24.0 tptm -108.83 -58.64 1.99 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.859 0.362 . . . . 70.340000000000003 111.359 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.6 mt-10 -136.33 139.97 42.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.057 0.456 . . . . 72.530000000000001 111.286 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -107.53 112.43 25.19 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 116.347 -0.388 . . . . 74.310000000000002 111.203 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.6 m -103.64 122.23 44.58 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.702 0.63 . . . . 72.230000000000004 112.702 -177.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -105.83 161.16 14.67 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.341 0.656 . . . . 73.219999999999999 111.574 175.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -108.41 116.23 31.58 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.321 -0.4 . . . . 74.430000000000007 110.899 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.644 HD12 HG21 ' A' ' 59' ' ' VAL . 65.5 mt -113.12 144.4 42.7 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.699 0.285 . . . . 53.310000000000002 110.747 176.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG2' ' OG ' ' A' ' 22' ' ' SER . 14.7 mmmm -102.4 126.13 49.33 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.779 0.324 . . . . 72.420000000000002 111.314 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 55.039999999999999 111.608 178.336 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 . . . . . 0 CA--C 1.537 0.444 0 CA-C-O 120.7 0.286 . . . . 74.409999999999997 111.099 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.9 ptp -95.11 114.18 25.95 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 121.121 0.486 . . . . 70.200000000000003 112.218 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 28.9 pt -99.01 135.67 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.307 -0.406 . . . . 71.319999999999993 110.654 175.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.0 mp0 -87.05 104.28 16.17 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.933 0.397 . . . . 71.439999999999998 110.637 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 48' ' ' LEU . 91.9 t -94.94 114.23 31.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.954 0.407 . . . . 73.549999999999997 111.423 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.483 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 29.5 t -107.52 131.49 54.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.098 0.475 . . . . 75.109999999999999 111.693 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.9 pt -123.51 147.86 54.02 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 115.947 -0.57 . . . . 61.520000000000003 111.313 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -53.27 151.4 22.63 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.999 2.466 . . . . 73.239999999999995 113.911 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.02 -47.65 61.61 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.664 0.987 . . . . 75.109999999999999 113.664 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.5 m -70.49 -4.12 21.22 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.906 0.706 . . . . 63.329999999999998 112.906 -174.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.25 119.84 77.71 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 120.581 0.229 . . . . 75.329999999999998 110.496 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.18 142.94 44.02 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.942 2.428 . . . . 45.149999999999999 113.693 -176.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.99 128.58 36.18 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.161 -0.472 . . . . 73.310000000000002 111.041 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -79.35 -63.7 1.36 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.407 0.521 . . . . 72.010000000000005 112.407 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 58.64 48.97 10.95 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 112.625 0.602 . . . . 72.510000000000005 112.625 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -75.99 -166.01 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.054 0.454 . . . . 75.230000000000004 112.071 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -91.48 158.74 16.31 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.406 0.521 . . . . 73.340000000000003 112.406 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.6 t80 -60.12 -22.1 62.4 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.891 0.701 . . . . 74.219999999999999 112.891 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.427 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 15.3 m120 -114.54 20.88 15.02 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.883 -0.511 . . . . 62.5 111.308 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.63 117.61 20.7 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.865 0.364 . . . . 53.240000000000002 111.734 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -73.53 111.28 8.52 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.282 -0.417 . . . . 73.450000000000003 111.008 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.558 HG12 HD23 ' A' ' 107' ' ' LEU . 34.6 m -117.41 159.32 17.63 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.286 0.565 . . . . 34.100000000000001 112.401 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -135.85 152.55 51.17 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.217 -0.447 . . . . 45.229999999999997 110.979 173.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.5 mt -100.73 138.54 37.64 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.552 0.575 . . . . 61.210000000000001 112.552 -173.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.21 111.54 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.883 -0.598 . . . . 75.140000000000001 110.698 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 20.3 m120 47.04 70.26 2.19 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.958 0.725 . . . . 54.009999999999998 112.958 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.33 151.95 17.91 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.982 2.455 . . . . 63.439999999999998 113.668 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 pt -141.1 139.99 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.22 -0.446 . . . . 73.420000000000002 111.054 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -89.24 102.71 15.37 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.675 0.274 . . . . 73.239999999999995 111.021 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t70 . . . . . 0 CA--C 1.55 0.952 0 CA-C-O 121.006 0.431 . . . . 75.340000000000003 111.54 -174.147 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 113.787 1.032 . . . . 74.349999999999994 113.787 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 34.7 m-85 -115.65 129.11 56.37 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.726 -1.124 . . . . 75.019999999999996 112.793 -174.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 55.7 mt -104.14 108.02 23.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.998 -0.546 . . . . 75.530000000000001 109.728 169.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.483 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 52.0 mtpt -93.48 138.49 31.72 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.501 -0.318 . . . . 73.010000000000005 111.464 -174.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.31 171.86 13.86 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.546 0.572 . . . . 62.439999999999998 112.546 -175.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 -42.55 40.71 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.712 -0.676 . . . . 64.329999999999998 111.252 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -163.95 158.62 19.89 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.164 -0.471 . . . . 74.310000000000002 111.07 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.538 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 42.1 mt -116.57 115.84 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 116.53 -0.305 . . . . 65.5 110.936 -179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.91 179.08 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 120.838 0.351 . . . . 62.020000000000003 111.314 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.558 HD23 HG12 ' A' ' 76' ' ' VAL . 97.9 mt -86.31 142.21 28.68 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.687 0.28 . . . . 74.230000000000004 110.889 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.389 . . . . 74.409999999999997 110.975 -179.727 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.1 mt . . . . . 0 N--CA 1.465 0.283 0 N-CA-C 109.608 -0.515 . . . . 65.430000000000007 109.608 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 mtpt -101.66 115.71 31.12 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.155 0.503 . . . . 75.230000000000004 110.802 -174.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.441 ' HA ' ' CD2' ' A' ' 48' ' ' LEU . 51.6 t80 -60.17 143.77 51.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.408 -0.814 . . . . 74.040000000000006 112.536 -174.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.542 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 34.3 t -121.3 -66.39 1.05 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.851 0.315 . . . . 62.299999999999997 111.851 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.91 178.01 9.29 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.027 0.441 . . . . 53.399999999999999 112.181 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 67' ' ' LEU . 58.6 tp -94.6 107.46 19.45 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.795 -0.446 . . . . 60.439999999999998 109.795 170.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 25' ' ' ARG . 15.7 tpt180 -65.23 -60.29 3.15 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.277 0.473 . . . . 71.430000000000007 112.277 -173.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -165.86 138.08 4.01 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.161 0.43 . . . . 74.239999999999995 112.161 -175.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 44' ' ' ARG . 39.2 mt-10 -96.51 101.83 13.52 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.284 -0.416 . . . . 71.109999999999999 110.079 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.3 m -69.83 125.92 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.118 0.485 . . . . 72.319999999999993 111.234 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.444 ' HG2' HG12 ' A' ' 41' ' ' ILE . 65.2 mtt85 -104.88 151.97 23.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.433 0.635 . . . . 71.129999999999995 112.373 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -66.81 122.03 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.083 -0.962 . . . . 62.0 112.438 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -99.27 132.82 44.33 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.425 -0.352 . . . . 72.340000000000003 111.048 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -86.11 169.66 12.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.498 0.555 . . . . 72.140000000000001 112.498 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 33' ' ' GLU . 2.4 mp0 -59.12 -35.79 74.06 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.559 -0.746 . . . . 62.509999999999998 111.499 -179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -60.49 -28.46 68.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.104 -0.498 . . . . 64.519999999999996 112.015 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.73 -29.67 7.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 121.177 -0.535 . . . . 33.43 112.368 -174.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.9 m -65.18 143.29 57.95 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.07 0.462 . . . . 64.019999999999996 111.62 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.79 135.48 35.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.057 0.456 . . . . 75.010000000000005 111.763 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.3 t -82.53 158.08 23.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.828 -0.624 . . . . 43.210000000000001 111.506 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -74.43 -8.13 55.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.135 0.493 . . . . 62.439999999999998 110.835 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.09 132.45 43.32 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.865 -0.607 . . . . 53.5 110.893 175.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 ' HG2' ' A' ' 29' ' ' ARG . 52.7 mt -97.99 148.6 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 120.835 0.35 . . . . 74.150000000000006 111.497 -175.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -102.73 -57.44 2.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.75 0.309 . . . . 71.439999999999998 111.068 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.02 151.97 44.5 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.884 0.373 . . . . 74.349999999999994 111.218 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 1.7 ptp180 -116.67 117.14 28.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.231 0.539 . . . . 64.340000000000003 111.27 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.1 m -91.48 123.52 34.96 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 73.140000000000001 112.584 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.502 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.5 m-85 -104.36 148.03 26.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.036 0.534 . . . . 74.239999999999995 110.943 174.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -94.5 120.9 35.44 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.839 0.352 . . . . 75.540000000000006 110.867 174.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 59' ' ' VAL . 63.4 mt -123.55 145.72 48.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.708 0.289 . . . . 71.340000000000003 110.821 177.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HE2' ' HB2' ' A' ' 22' ' ' SER . 0.0 OUTLIER -112.3 141.64 45.78 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.989 0.424 . . . . 65.150000000000006 111.007 174.933 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 73.230000000000004 111.822 -177.896 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 120.911 0.386 . . . . 75.120000000000005 111.543 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptm -95.39 148.26 22.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.516 0.675 . . . . 74.200000000000003 111.892 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 100' ' ' ILE . 22.5 pt -130.78 150.88 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 115.414 -0.812 . . . . 72.530000000000001 109.759 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.675 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -107.01 105.35 15.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.205 -0.998 . . . . 71.349999999999994 111.32 177.754 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.606 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -94.72 121.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.307 -0.406 . . . . 75.540000000000006 111.303 -177.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' ' HG2' ' A' ' 101' ' ' LYS . 91.3 p -113.63 131.75 56.02 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.418 0.628 . . . . 72.049999999999997 111.503 -178.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.9 pt -122.86 145.4 45.43 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.724 -0.671 . . . . 72.109999999999999 110.302 175.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.82 147.74 17.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.45 2.1 . . . . 61.149999999999999 113.231 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.2 -22.71 63.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.882 0.372 . . . . 61.210000000000001 111.701 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 57.5 p -65.51 -21.38 66.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.305 -0.407 . . . . 70.319999999999993 111.742 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.3 t -85.54 124.5 71.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-N 116.562 -0.29 . . . . 74.430000000000007 110.939 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.92 159.45 7.22 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.161 2.574 . . . . 55.030000000000001 114.617 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 45.2 tp -75.4 128.42 35.33 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.981 -0.554 . . . . 64.030000000000001 111.186 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.92 -64.26 1.2 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.942 0.719 . . . . 74.010000000000005 112.942 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.534 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.7 mt-10 57.02 52.66 8.9 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.843 0.683 . . . . 72.409999999999997 112.843 -178.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.48 173.0 9.45 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.006 -0.434 . . . . 72.200000000000003 111.464 173.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.16 160.57 31.85 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.974 0.416 . . . . 74.439999999999998 111.845 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -71.2 134.46 46.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.941 -0.392 . . . . 73.409999999999997 109.941 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 68.52 12.66 8.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.983 0.513 . . . . 75.349999999999994 112.153 -175.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.49 136.96 54.0 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.88 0.372 . . . . 54.399999999999999 111.576 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -78.27 104.59 8.95 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.439 -0.346 . . . . 74.310000000000002 110.873 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 32.5 m -124.62 154.62 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 121.311 0.577 . . . . 55.350000000000001 111.955 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -130.01 155.69 45.7 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.26 0.552 . . . . 73.219999999999999 110.866 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.2 mt -103.04 139.28 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.529 0.68 . . . . 63.439999999999998 112.421 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.6 mm -85.06 106.66 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.581 -0.736 . . . . 65.439999999999998 110.518 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m120 54.6 68.57 2.57 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.335 0.494 . . . . 71.299999999999997 112.335 -176.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.04 130.8 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.724 2.282 . . . . 63.109999999999999 113.452 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 pt -124.91 142.97 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.734 0.302 . . . . 74.219999999999999 111.317 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.66 115.78 26.44 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.6 0.238 . . . . 73.209999999999994 110.914 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 121.168 0.509 . . . . 71.430000000000007 111.226 -179.655 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.548 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.259 1.562 0 CA-C-O 122.84 1.305 . . . . 74.340000000000003 114.275 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.675 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 80.1 m-85 -84.86 112.81 20.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 113.377 -1.738 . . . . 75.030000000000001 110.418 169.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 57' ' ' ILE . 30.4 mt -90.43 104.34 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.3 0.571 . . . . 62.509999999999998 109.698 177.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.549 ' HG2' ' OG ' ' A' ' 60' ' ' SER . 96.5 mttt -85.21 131.5 34.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 55.409999999999997 111.618 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.93 155.62 45.76 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.177 0.513 . . . . 73.5 112.194 -177.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -68.83 -39.14 80.14 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.753 -0.658 . . . . 65.129999999999995 110.94 176.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -164.31 162.09 22.19 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.029 -0.532 . . . . 74.099999999999994 111.422 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.47 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 39.9 mt -118.75 115.93 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.363 -0.38 . . . . 74.219999999999999 111.077 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -125.01 170.52 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-O 120.743 0.306 . . . . 73.209999999999994 111.682 -178.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.2 mt -72.15 139.09 48.12 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 75.310000000000002 110.921 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.47 0.538 0 CA-C-N 116.605 -0.271 . . . . 50.549999999999997 111.722 179.639 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 70.0 mt . . . . . 0 CA--C 1.533 0.326 0 CA-C-O 121.209 0.528 . . . . 70.230000000000004 111.278 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.721 ' HG2' ' HA ' ' A' ' 73' ' ' ASN . 0.2 OUTLIER -158.49 133.31 8.31 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.002 0.43 . . . . 74.430000000000007 111.894 -179.606 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.465 ' HA ' HD22 ' A' ' 48' ' ' LEU . 36.1 t80 -72.74 143.99 47.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.118 -0.492 . . . . 75.349999999999994 111.566 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 t -125.03 -65.39 1.03 Allowed 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.348 -0.22 . . . . 62.450000000000003 111.413 174.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.16 -173.84 4.06 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.916 0.388 . . . . 64.310000000000002 112.039 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.4 tp -94.94 133.08 39.08 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.806 0.336 . . . . 74.450000000000003 111.134 174.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -88.29 -65.06 1.06 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.837 0.351 . . . . 75.040000000000006 111.836 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -164.32 142.93 7.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.846 0.355 . . . . 70.120000000000005 111.698 -176.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -106.59 98.98 8.59 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.871 -0.418 . . . . 75.319999999999993 109.871 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 28' ' ' VAL . 28.8 m -71.8 92.3 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 121.864 0.84 . . . . 73.120000000000005 111.352 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.652 ' HG2' HG12 ' A' ' 41' ' ' ILE . 71.5 mtt180 -83.34 159.45 21.86 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.583 -0.735 . . . . 74.420000000000002 112.344 -177.011 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.9 mt -81.01 132.93 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.56 -0.745 . . . . 74.409999999999997 110.911 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -110.57 128.17 55.54 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.837 0.351 . . . . 75.140000000000001 110.536 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -67.79 153.39 43.82 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.638 0.606 . . . . 72.420000000000002 112.638 -173.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.95 -36.94 60.58 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.281 0.563 . . . . 55.25 110.742 172.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -51.05 -42.65 60.66 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.377 -0.829 . . . . 61.149999999999999 111.617 175.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.95 -39.98 1.64 Allowed Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.367 -0.444 . . . . 64.120000000000005 112.55 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.5 m -68.98 148.27 50.38 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.183 0.516 . . . . 73.340000000000003 111.938 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.64 137.73 20.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.081 -0.509 . . . . 64.120000000000005 111.673 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -88.6 166.92 13.8 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.108 0.48 . . . . 72.150000000000006 111.727 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -87.81 -7.62 57.03 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.359 -0.382 . . . . 64.209999999999994 110.95 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.18 135.74 46.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.912 0.387 . . . . 74.230000000000004 110.318 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.652 HG12 ' HG2' ' A' ' 29' ' ' ARG . 39.1 mt -111.48 157.75 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.158 0.504 . . . . 70.209999999999994 111.564 -173.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -97.32 -55.1 2.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.073 0.463 . . . . 65.209999999999994 110.387 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.419 ' H ' HG23 ' A' ' 28' ' ' VAL . 33.3 mt-10 -143.9 155.35 44.05 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.989 -0.55 . . . . 71.25 111.348 175.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.439 ' O ' HG12 ' A' ' 61' ' ' ILE . 39.7 ttm180 -115.99 110.65 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.985 0.421 . . . . 73.340000000000003 110.241 175.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 90.9 m -94.98 125.55 39.72 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.292 0.479 . . . . 73.340000000000003 112.292 -175.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -108.06 158.08 17.71 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.26 0.553 . . . . 73.420000000000002 112.371 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -96.55 107.21 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.539 -0.755 . . . . 75.420000000000002 110.659 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.775 HD12 HG21 ' A' ' 59' ' ' VAL . 56.6 mt -120.43 160.56 22.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.204 0.526 . . . . 65.209999999999994 111.433 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -115.45 145.6 42.43 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.235 -0.438 . . . . 75.129999999999995 110.871 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.1 m . . . . . 0 N--CA 1.475 0.796 0 O-C-N 122.216 -0.303 . . . . 45.240000000000002 111.759 179.98 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 121.071 0.462 . . . . 65.349999999999994 111.407 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.87 149.19 22.75 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.115 0.483 . . . . 74.340000000000003 111.134 176.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.573 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 31.2 pt -124.46 136.3 61.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 72.349999999999994 110.668 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 18.1 mm-40 -94.58 104.41 16.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.428 -0.509 . . . . 62.509999999999998 110.461 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.775 HG21 HD12 ' A' ' 48' ' ' LEU . 95.6 t -95.01 117.05 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.937 0.347 . . . . 74.239999999999995 111.937 -174.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.7 m -106.97 116.55 32.11 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.381 -0.372 . . . . 53.030000000000001 111.191 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HG13 ' A' ' 105' ' ' ILE . 21.8 pt -110.16 148.9 39.29 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.186 -0.461 . . . . 73.329999999999998 111.126 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.34 153.85 56.98 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.517 2.145 . . . . 51.520000000000003 113.195 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.42 -19.19 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.55 0.574 . . . . 34.409999999999997 112.55 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.8 m -68.35 -9.33 47.3 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.686 0.279 . . . . 70.540000000000006 111.689 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.456 HG11 HD12 ' A' ' 61' ' ' ILE . 45.5 t -92.8 132.14 31.96 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 116.481 -0.327 . . . . 64.430000000000007 111.501 179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -177.09 1.9 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.594 2.196 . . . . 73.420000000000002 113.778 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' A' ' 69' ' ' GLU . 30.9 tp -82.67 141.68 32.27 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.088 -0.506 . . . . 75.109999999999999 111.806 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.405 ' HE2' HG12 ' A' ' 65' ' ' VAL . 4.7 mptp? -102.4 -68.2 0.84 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.858 0.361 . . . . 75.239999999999995 111.643 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 38.1 mm-40 50.75 56.12 8.48 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.668 0.618 . . . . 75.420000000000002 112.668 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -75.73 171.49 14.27 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.0 0.429 . . . . 71.129999999999995 111.189 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -71.52 151.46 43.87 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 75.099999999999994 112.305 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.409 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 82.0 t80 -56.98 121.85 10.91 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.726 -0.67 . . . . 65.019999999999996 110.798 174.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.721 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 6.6 m-20 72.09 30.39 2.16 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.678 0.622 . . . . 74.120000000000005 112.678 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -84.25 145.1 28.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.535 -0.302 . . . . 62.109999999999999 110.512 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -74.46 114.99 13.48 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.165 -0.335 . . . . 72.129999999999995 111.458 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.512 HG12 HD23 ' A' ' 107' ' ' LEU . 31.0 m -125.5 147.24 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 120.671 0.272 . . . . 62.210000000000001 111.599 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.38 149.59 50.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.876 0.369 . . . . 71.0 110.789 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.415 ' CD2' HG12 ' A' ' 105' ' ' ILE . 98.1 mt -102.16 137.18 40.76 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.591 0.589 . . . . 53.450000000000003 112.591 -172.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.8 mm -83.68 106.67 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.909 -0.587 . . . . 71.349999999999994 110.515 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 62.09 64.35 1.86 Allowed Pre-proline 0 N--CA 1.476 0.862 0 CA-C-N 116.268 -0.424 . . . . 72.400000000000006 112.138 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.98 128.86 6.7 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.62 2.214 . . . . 62.240000000000002 112.979 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.6 pt -135.06 127.48 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.962 0.41 . . . . 75.310000000000002 111.565 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.12 99.69 3.44 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.875 -0.417 . . . . 75.019999999999996 109.875 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 CA--C 1.541 0.618 0 CA-C-O 121.298 0.57 . . . . 73.109999999999999 112.24 -171.259 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.573 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.245 0.823 0 N-CA-C 113.998 1.11 . . . . 73.340000000000003 113.998 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 70.6 m-85 -97.2 117.37 31.26 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.552 -1.204 . . . . 72.0 111.026 175.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 28.6 mt -95.92 105.47 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 121.18 0.514 . . . . 73.340000000000003 110.194 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -78.66 136.16 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.171 -0.468 . . . . 52.340000000000003 111.306 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.38 155.53 47.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.387 -0.37 . . . . 74.439999999999998 110.657 179.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -80.82 -23.64 39.06 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.55 0.214 . . . . 71.239999999999995 111.333 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -169.89 159.54 7.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.276 0.56 . . . . 63.0 111.741 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.478 HG13 HG21 ' A' ' 61' ' ' ILE . 37.0 mt -119.57 109.07 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.844 -0.616 . . . . 71.430000000000007 111.223 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.0 m -113.16 178.63 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 120.834 0.35 . . . . 72.349999999999994 111.084 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG12 ' A' ' 76' ' ' VAL . 96.1 mt -88.04 151.33 22.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.19 0.519 . . . . 75.209999999999994 111.331 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 110.138 -0.319 . . . . 73.530000000000001 110.138 176.417 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.451 ' HB2' HG23 ' A' ' 76' ' ' VAL . 99.1 mt . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 121.141 0.496 . . . . 54.539999999999999 110.57 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -101.85 105.64 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.189 0.519 . . . . 74.200000000000003 111.298 -175.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -58.6 135.49 57.37 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.409 -0.814 . . . . 73.349999999999994 112.651 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.6 m -113.17 -62.47 1.58 Allowed 'General case' 0 N--CA 1.471 0.615 0 O-C-N 122.039 -0.413 . . . . 73.25 111.529 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' H ' ' HB2' ' A' ' 47' ' ' ASP . . . -153.9 163.17 40.49 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.299 0.571 . . . . 62.420000000000002 112.104 -178.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 51.4 tp -74.81 111.8 10.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.319 -0.622 . . . . 50.409999999999997 109.319 171.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 13.4 tpt180 -63.54 -50.03 71.13 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.666 -0.243 . . . . 71.310000000000002 111.651 -172.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -176.74 147.58 0.63 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.531 0.567 . . . . 74.349999999999994 112.531 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.467 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 43.6 mt-10 -105.93 102.38 11.82 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.972 -0.558 . . . . 73.319999999999993 110.419 171.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -81.54 113.12 20.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 121.495 0.664 . . . . 63.310000000000002 110.267 174.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -101.1 157.1 17.02 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.138 -0.483 . . . . 64.239999999999995 110.681 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.2 mt -67.42 108.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.238 0.542 . . . . 53.450000000000003 111.741 -175.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -88.94 119.48 29.5 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.364 -0.38 . . . . 71.409999999999997 110.925 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.67 158.32 32.49 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.199 0.444 . . . . 74.200000000000003 112.199 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.37 -17.31 28.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.374 -0.375 . . . . 72.239999999999995 111.558 174.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.34 -4.79 35.53 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.327 -0.397 . . . . 64.109999999999999 111.851 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -28.66 10.3 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.318 -0.467 . . . . 22.23 113.181 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.2 m -81.98 153.64 26.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.057 0.456 . . . . 71.109999999999999 111.901 -178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.17 133.79 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.133 0.492 . . . . 71.140000000000001 111.404 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -84.03 167.33 16.96 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.334 0.588 . . . . 74.040000000000006 112.225 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.65 -25.07 64.63 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.758 -0.655 . . . . 64.209999999999994 110.72 176.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -76.4 131.33 39.05 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.848 -0.614 . . . . 61.509999999999998 111.623 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -94.72 149.0 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.417 -0.356 . . . . 61.200000000000003 110.765 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -92.92 -57.36 2.67 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.65 0.262 . . . . 75.310000000000002 111.23 -177.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' OE1' ' HE3' ' A' ' 101' ' ' LYS . 14.7 pt-20 -163.82 168.66 19.3 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.748 0.309 . . . . 72.400000000000006 111.22 176.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.527 ' HD3' HD13 ' A' ' 67' ' ' LEU . 45.6 mtt180 -128.18 125.63 39.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.565 0.579 . . . . 75.439999999999998 112.565 -174.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 28.9 m -100.05 133.29 44.66 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 116.035 -0.529 . . . . 71.219999999999999 112.091 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.59 151.6 35.88 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.076 0.55 . . . . 72.129999999999995 112.39 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.498 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 31.8 m-20 -91.24 107.62 19.33 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.048 -0.524 . . . . 71.430000000000007 111.276 171.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.427 HD12 HG21 ' A' ' 59' ' ' VAL . 77.0 mt -116.08 120.72 39.98 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.919 0.39 . . . . 73.400000000000006 110.724 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.726 ' NZ ' ' SD ' ' A' ' 56' ' ' MET . 71.7 mmtt -92.7 148.34 22.13 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.41 -0.359 . . . . 52.530000000000001 110.853 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.718 0.294 . . . . 51.420000000000002 111.568 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 120.596 0.236 . . . . 75.209999999999994 110.72 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.726 ' SD ' ' NZ ' ' A' ' 49' ' ' LYS . 21.4 ptt? -145.7 168.8 19.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.926 0.393 . . . . 44.299999999999997 111.664 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.56 134.52 46.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.009 -0.541 . . . . 73.150000000000006 110.749 176.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.37 105.37 17.45 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.905 0.383 . . . . 73.219999999999999 110.506 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 67.5 t -97.33 120.17 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 120.944 0.402 . . . . 71.109999999999999 111.927 -173.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 15.4 t -109.47 115.1 29.3 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.911 0.386 . . . . 42.149999999999999 111.61 -178.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -103.6 151.57 38.74 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 116.512 -0.313 . . . . 64.129999999999995 111.676 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.47 148.6 90.25 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.71 2.273 . . . . 73.109999999999999 113.303 -178.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -15.07 63.45 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.725 0.639 . . . . 61.409999999999997 112.725 -177.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 43.9 t -64.02 -20.58 66.01 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.981 0.42 . . . . 73.200000000000003 111.114 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.0 t -92.84 122.69 63.37 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.188 -0.46 . . . . 74.420000000000002 111.207 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.09 151.45 16.59 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.97 2.447 . . . . 71.540000000000006 113.637 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.527 HD13 ' HD3' ' A' ' 44' ' ' ARG . 28.7 tp -69.73 141.35 53.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.277 -0.419 . . . . 71.25 111.576 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -81.4 -57.63 3.4 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.028 0.751 . . . . 73.310000000000002 113.028 -170.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 59.5 41.86 18.51 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.263 0.468 . . . . 71.340000000000003 112.263 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.54 168.22 7.74 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.209 0.528 . . . . 54.420000000000002 111.651 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.89 153.35 43.39 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.495 -0.32 . . . . 72.019999999999996 110.911 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 59.0 t80 -62.64 119.05 8.49 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.795 0.331 . . . . 72.340000000000003 111.335 -178.155 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.44 HD22 ' N ' ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.54 19.8 5.0 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.246 0.618 . . . . 72.219999999999999 112.1 -178.159 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.77 141.21 58.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.088 0.47 . . . . 71.150000000000006 110.891 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 75' ' ' ARG . 29.4 mtp180 -72.94 112.65 9.17 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.932 -0.577 . . . . 74.430000000000007 111.128 -177.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.53 HG12 HD23 ' A' ' 107' ' ' LEU . 32.4 m -126.45 161.47 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.201 0.524 . . . . 71.340000000000003 111.891 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -143.02 154.26 43.81 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.014 0.435 . . . . 71.109999999999999 110.843 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.7 mt -95.3 142.66 27.44 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.527 0.565 . . . . 74.510000000000005 112.527 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.61 -77.58 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 CA-C-N 116.067 -0.515 . . . . 62.539999999999999 110.906 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -130.78 92.23 34.87 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.744 0.306 . . . . 72.409999999999997 111.173 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -82.68 156.94 16.11 Favored 'Trans proline' 0 CA--C 1.546 1.095 0 C-N-CA 123.246 2.631 . . . . 23.440000000000001 114.25 177.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 pt -145.46 132.87 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.332 0.653 . . . . 74.519999999999996 110.558 173.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.04 116.0 15.29 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.12 -0.363 . . . . 53.439999999999998 110.857 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.7 t70 . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 120.902 0.382 . . . . 73.519999999999996 111.733 -174.081 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.426 ' CH2' HD11 ' A' ' 100' ' ' ILE . 1.3 p-90 . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 121.274 0.559 . . . . 71.400000000000006 112.33 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -111.05 126.09 54.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 121.634 0.73 . . . . 74.420000000000002 112.737 -172.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 63.6 mt -116.51 125.1 73.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.557 -0.747 . . . . 75.409999999999997 110.937 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HE3' ' OE1' ' A' ' 43' ' ' GLU . 56.6 mtpt -90.39 143.14 27.04 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.723 -0.473 . . . . 71.129999999999995 109.723 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.95 164.0 29.38 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.054 0.761 . . . . 70.030000000000001 113.054 -174.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.3 -58.75 5.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.235 -0.893 . . . . 75.329999999999998 110.914 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -164.37 163.25 22.45 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.205 -0.452 . . . . 75.209999999999994 111.492 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 50.2 mt -120.02 124.76 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.083 -0.508 . . . . 74.200000000000003 111.189 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.2 m -123.34 179.29 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 122.282 -0.261 . . . . 74.329999999999998 111.291 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 76' ' ' VAL . 93.0 mt -81.04 151.76 28.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.856 0.36 . . . . 75.140000000000001 111.311 178.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 24.7 m . . . . . 0 N--CA 1.471 0.611 0 CA-C-O 120.898 0.38 . . . . 73.519999999999996 111.955 -179.031 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 109.588 -0.523 . . . . 75.439999999999998 109.588 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -125.71 129.37 49.4 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.49 0.662 . . . . 61.140000000000001 112.665 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -67.66 138.12 56.09 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.313 -0.858 . . . . 73.409999999999997 112.348 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.46 ' OG ' ' HD3' ' A' ' 49' ' ' LYS . 59.1 m -113.47 -64.7 1.27 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 111.893 0.331 . . . . 53.25 111.893 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.43 168.97 24.0 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.293 0.568 . . . . 74.310000000000002 112.393 -177.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.41 HD21 ' HG3' ' A' ' 27' ' ' GLU . 64.8 tp -81.41 112.09 18.36 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.57 -0.741 . . . . 70.129999999999995 110.278 172.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -68.51 -52.64 29.94 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.81 0.338 . . . . 61.350000000000001 111.34 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -175.56 134.84 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.058 0.392 . . . . 64.230000000000004 112.058 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.532 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.3 mt-10 -93.16 98.41 11.28 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.895 -0.409 . . . . 73.450000000000003 109.895 169.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.5 m -70.41 128.08 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.968 0.414 . . . . 72.040000000000006 110.752 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 41' ' ' ILE . 62.6 mtt180 -100.96 168.6 9.51 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.564 0.697 . . . . 73.349999999999994 112.804 -175.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.92 112.43 10.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.312 -0.858 . . . . 71.400000000000006 111.116 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.5 tt0 -84.96 115.0 22.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.861 0.362 . . . . 73.329999999999998 111.081 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -55.76 144.9 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.195 -0.457 . . . . 52.420000000000002 111.217 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -55.49 -24.01 29.09 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.365 0.505 . . . . 60.119999999999997 112.365 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.76 -37.9 74.45 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.007 0.432 . . . . 74.400000000000006 111.552 173.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.52 -17.24 5.57 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.35 -0.453 . . . . 53.310000000000002 113.098 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.4 m -94.77 148.83 21.88 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.31 -0.523 . . . . 74.329999999999998 111.754 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.581 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 34.1 t -82.38 143.62 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 120.949 0.404 . . . . 71.420000000000002 111.794 -177.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -94.02 178.84 5.52 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.037 0.446 . . . . 52.140000000000001 111.771 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -85.07 -21.42 29.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.3 -0.409 . . . . 64.450000000000003 111.29 177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -69.74 136.63 51.18 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.474 -0.33 . . . . 74.349999999999994 110.805 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 29' ' ' ARG . 50.7 mt -90.39 144.73 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.339 0.59 . . . . 74.230000000000004 111.858 -175.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.513 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 28.9 tptp -97.9 -59.18 1.82 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.626 -0.715 . . . . 42.43 110.904 179.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.513 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.9 mt-10 -145.92 170.21 17.05 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.993 0.425 . . . . 75.420000000000002 111.089 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 54.5 mtt180 -128.1 119.05 24.55 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.778 0.431 . . . . 53.210000000000001 111.367 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 62.9 m -100.99 131.42 46.88 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.27 0.47 . . . . 63.210000000000001 112.27 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.482 ' OH ' HD12 ' A' ' 67' ' ' LEU . 39.6 m-85 -125.08 156.33 38.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.719 0.407 . . . . 72.319999999999993 111.38 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -99.97 123.04 43.78 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.693 -0.23 . . . . 71.340000000000003 111.413 173.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.499 HD12 HG21 ' A' ' 59' ' ' VAL . 51.6 mt -119.72 130.21 54.89 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.805 0.336 . . . . 75.430000000000007 111.498 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.507 ' HE3' ' SD ' ' A' ' 56' ' ' MET . 14.3 mptt -80.83 115.54 20.37 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.624 0.249 . . . . 75.349999999999994 110.834 173.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 120.679 0.276 . . . . 74.329999999999998 111.187 177.387 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 120.982 0.42 . . . . 72.510000000000005 111.708 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.507 ' SD ' ' HE3' ' A' ' 49' ' ' LYS . 63.8 mtm -93.56 107.73 19.55 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.638 -0.505 . . . . 71.409999999999997 109.638 168.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.457 HD12 HD12 ' A' ' 100' ' ' ILE . 24.2 pt -94.71 134.83 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.465 0.174 . . . . 64.129999999999995 111.393 -174.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -90.6 104.94 17.46 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 75.400000000000006 111.204 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 91.9 t -96.59 128.37 47.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.91 -0.587 . . . . 75.120000000000005 111.31 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.624 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 48.9 m -123.08 137.82 54.83 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 65.019999999999996 111.891 -176.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 pt -124.42 147.81 56.43 Favored Pre-proline 0 N--CA 1.472 0.671 0 CA-C-N 116.213 -0.449 . . . . 63.340000000000003 110.798 177.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.36 150.54 86.82 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.298 1.999 . . . . 72.420000000000002 112.482 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.13 -32.94 37.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.763 0.653 . . . . 64.150000000000006 112.763 -176.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.8 m -53.46 -32.81 51.69 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.233 0.457 . . . . 71.420000000000002 112.233 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -82.08 116.15 61.73 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.616 -0.265 . . . . 43.520000000000003 110.748 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -49.74 141.43 27.67 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.163 2.575 . . . . 73.409999999999997 113.755 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.57 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 31.6 tp -52.63 138.0 29.44 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.302 -0.408 . . . . 50.240000000000002 110.844 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.523 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 24.7 mmmt -79.97 -57.55 3.59 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.621 0.6 . . . . 74.239999999999995 112.621 -170.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.57 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 39.2 mt-10 57.86 39.57 26.74 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 112.592 0.59 . . . . 64.129999999999995 112.592 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -70.66 172.69 8.23 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.168 0.508 . . . . 74.310000000000002 112.056 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.577 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 5.8 m-20 -70.17 157.72 37.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.381 0.61 . . . . 65.219999999999999 112.084 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.425 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 7.6 t80 -70.66 117.38 12.11 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.793 -0.639 . . . . 72.349999999999994 110.902 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 46.9 m-80 74.92 21.82 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.592 0.757 . . . . 64.430000000000007 112.069 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.577 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -74.95 141.63 44.04 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.963 0.357 . . . . 51.399999999999999 111.963 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 70.7 mtm180 -67.45 116.16 7.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.599 -0.273 . . . . 71.010000000000005 110.717 178.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.52 140.03 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-O 121.042 0.449 . . . . 75.409999999999997 112.171 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.431 ' HG3' HG23 ' A' ' 106' ' ' VAL . 8.1 pt-20 -124.53 157.16 35.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.232 0.539 . . . . 64.150000000000006 111.025 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.95 132.13 45.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.262 -0.427 . . . . 72.0 111.777 -176.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.435 HG22 ' OD1' ' A' ' 80' ' ' ASN . 50.0 mm -63.62 -72.61 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 116.28 -0.418 . . . . 64.540000000000006 111.364 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.488 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 23.3 m120 -125.32 89.96 51.64 Favored Pre-proline 0 N--CA 1.476 0.858 0 CA-C-O 120.573 0.225 . . . . 52.229999999999997 110.452 174.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.87 147.7 15.24 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.202 2.601 . . . . 64.219999999999999 114.352 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 101' ' ' LYS . 38.4 pt -140.04 149.14 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.967 0.413 . . . . 72.439999999999998 110.78 172.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.14 116.51 28.87 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.916 0.388 . . . . 70.25 110.816 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.536 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . 17.9 t70 . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 121.479 0.657 . . . . 74.120000000000005 112.442 -174.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.965 0 CA-C-O 122.545 1.164 . . . . 72.310000000000002 113.982 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -110.39 122.27 47.28 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.25 -1.341 . . . . 75.340000000000003 111.094 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 34.6 mt -105.27 104.63 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.085 0.469 . . . . 73.439999999999998 110.46 177.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.624 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 50.3 mtpt -87.42 130.26 34.73 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.997 -0.44 . . . . 71.329999999999998 111.17 -176.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.12 157.93 31.81 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.651 0.611 . . . . 50.549999999999997 112.651 -173.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 28.9 t70 -66.95 -38.37 86.01 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.469 -0.787 . . . . 64.420000000000002 111.294 175.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -169.8 161.08 8.98 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.168 -0.469 . . . . 72.540000000000006 110.951 176.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.523 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 42.3 mt -119.28 120.98 65.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.148 -0.478 . . . . 63.240000000000002 110.883 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.431 HG23 ' HG3' ' A' ' 77' ' ' GLU . 27.8 m -120.42 -179.65 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 122.218 -0.301 . . . . 44.43 111.105 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.5 128.47 35.23 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.944 0.402 . . . . 63.329999999999998 111.901 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.492 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 26.4 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.429 0.633 . . . . 65.340000000000003 111.234 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 50' ' ' SER . 97.2 mt . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.804 0.335 . . . . 74.239999999999995 111.222 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -102.62 139.06 38.7 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.987 0.423 . . . . 51.219999999999999 111.21 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 67.5 t80 -71.98 102.06 2.85 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.275 -0.421 . . . . 71.239999999999995 110.581 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.552 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.3 t -73.29 -64.83 0.9 Allowed 'General case' 0 N--CA 1.472 0.625 0 O-C-N 122.018 -0.426 . . . . 71.010000000000005 111.864 -175.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.57 171.67 17.65 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.608 0.596 . . . . 75.430000000000007 112.608 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.451 HD13 ' CE2' ' A' ' 46' ' ' TYR . 37.1 tp -90.06 105.83 18.07 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.853 -0.612 . . . . 73.109999999999999 109.486 169.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 25' ' ' ARG . 16.0 tpt180 -65.82 -53.14 43.96 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.487 -0.324 . . . . 75.409999999999997 111.546 -175.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -177.01 141.21 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.247 0.462 . . . . 74.230000000000004 112.247 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.41 98.89 11.51 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.647 -0.501 . . . . 71.019999999999996 109.647 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 42' ' ' LYS . 31.9 m -78.16 144.78 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-O 121.303 0.573 . . . . 74.5 111.773 -174.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm180 -109.56 168.35 9.46 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.949 -0.569 . . . . 65.209999999999994 112.109 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.0 mt -80.99 141.78 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.977 -0.556 . . . . 61.539999999999999 111.164 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -95.45 150.74 19.96 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.088 0.471 . . . . 72.129999999999995 111.707 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -93.55 155.45 17.3 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.489 -0.323 . . . . 62.509999999999998 110.427 174.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -62.19 -21.34 65.02 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.216 0.532 . . . . 74.430000000000007 111.344 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.54 -31.89 70.97 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.917 -0.583 . . . . 62.25 111.582 172.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.53 -34.86 4.47 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 116.222 -0.444 . . . . 51.340000000000003 112.156 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.7 m -68.14 153.92 42.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.004 0.431 . . . . 74.200000000000003 111.319 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -87.28 146.33 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 120.819 0.343 . . . . 73.430000000000007 111.5 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.9 t -90.53 172.4 8.73 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.213 0.53 . . . . 72.239999999999995 112.208 -179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -81.07 -15.54 55.72 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.998 -0.546 . . . . 63.32 110.628 173.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.08 135.87 56.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.817 -0.629 . . . . 74.299999999999997 110.75 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.93 142.96 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-O 120.929 0.395 . . . . 73.340000000000003 111.266 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HG23 ' A' ' 28' ' ' VAL . 29.1 tptp -98.31 -58.26 2.01 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.955 0.407 . . . . 55.200000000000003 111.267 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -164.4 166.44 20.65 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.089 0.471 . . . . 71.430000000000007 111.291 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 60' ' ' SER . 38.3 mtt180 -114.5 114.39 25.73 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.001 0.371 . . . . 75.329999999999998 112.001 -173.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.0 m -91.64 126.92 36.89 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.169 -0.469 . . . . 64.329999999999998 112.055 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CE2' HD13 ' A' ' 24' ' ' LEU . 92.8 m-85 -123.61 151.75 42.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.209 0.604 . . . . 73.209999999999994 111.527 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 22' ' ' SER . 69.5 m-20 -102.08 119.27 38.53 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.238 -0.437 . . . . 75.329999999999998 110.938 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.642 HD12 HG21 ' A' ' 59' ' ' VAL . 39.6 mt -114.55 141.22 48.02 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.987 0.422 . . . . 75.510000000000005 111.922 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HG2' ' HB2' ' A' ' 22' ' ' SER . 29.0 mmmt -96.21 124.54 40.25 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.0 -0.545 . . . . 73.099999999999994 111.121 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HA ' HD23 ' A' ' 19' ' ' LEU . 29.1 t . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 120.894 0.378 . . . . 52.299999999999997 111.477 177.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 . . . . . 0 CA--C 1.537 0.473 0 CA-C-O 121.27 0.557 . . . . 62.049999999999997 111.448 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.0 OUTLIER -110.16 131.25 55.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.897 -0.592 . . . . 63.520000000000003 110.904 175.821 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 100' ' ' ILE . 24.4 pt -115.02 142.99 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 116.523 -0.308 . . . . 64.420000000000002 111.359 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.2 mp0 -89.99 104.99 17.5 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.82 0.343 . . . . 71.140000000000001 110.572 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.642 HG21 HD12 ' A' ' 48' ' ' LEU . 87.2 t -100.6 129.94 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.079 -0.388 . . . . 70.540000000000006 111.424 -178.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.496 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 38.2 t -127.7 151.14 49.34 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.336 0.589 . . . . 62.43 112.275 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.9 pt -134.42 141.04 37.56 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 115.861 -0.609 . . . . 72.400000000000006 110.609 176.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.425 ' HG2' HG23 ' A' ' 65' ' ' VAL . 15.5 Cg_endo -56.35 152.25 40.25 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.4 2.067 . . . . 74.239999999999995 112.936 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.59 -30.12 19.82 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.301 0.852 . . . . 73.299999999999997 113.301 -177.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.5 p -67.26 -20.26 65.63 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.412 0.523 . . . . 64.530000000000001 112.412 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.425 HG23 ' HG2' ' A' ' 62' ' ' PRO . 53.2 t -84.78 132.27 46.79 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 120.536 0.208 . . . . 61.009999999999998 111.37 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.04 158.98 8.14 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.114 2.543 . . . . 74.140000000000001 113.818 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.5 tp -76.0 129.65 37.2 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.954 -0.566 . . . . 63.210000000000001 111.77 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 0.0 OUTLIER -86.88 123.46 32.04 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.113 0.482 . . . . 70.420000000000002 111.366 174.838 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -116.72 49.28 1.18 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.715 -0.675 . . . . 71.400000000000006 111.397 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -84.4 177.01 8.31 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.948 0.722 . . . . 72.5 112.948 -174.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.3 159.25 15.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.553 -0.749 . . . . 71.310000000000002 111.624 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.615 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.1 t80 -59.86 -35.35 74.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.298 0.481 . . . . 74.219999999999999 112.298 -179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -93.73 2.65 56.21 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 122.133 -0.355 . . . . 35.399999999999999 111.474 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.17 135.04 42.81 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.015 0.436 . . . . 62.229999999999997 111.802 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -79.53 126.42 30.85 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.166 -0.47 . . . . 54.310000000000002 110.327 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.2 m -129.28 142.45 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.284 0.564 . . . . 72.0 112.516 -178.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.25 170.53 14.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.928 -0.578 . . . . 64.129999999999995 110.773 177.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.3 133.36 55.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.866 0.365 . . . . 71.120000000000005 111.923 -176.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.425 HG22 ' OD1' ' A' ' 80' ' ' ASN . 50.1 mm -64.97 -65.58 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.158 -0.474 . . . . 63.119999999999997 111.645 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.5 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 26.1 m120 -129.04 89.24 49.18 Favored Pre-proline 0 N--CA 1.474 0.744 0 O-C-N 122.18 -0.325 . . . . 63.509999999999998 110.669 174.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.04 141.7 13.26 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.927 2.418 . . . . 72.319999999999993 114.07 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.5 pt -133.34 129.66 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.982 0.42 . . . . 63.43 110.787 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.86 114.26 8.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.865 0.364 . . . . 43.25 110.825 175.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 CA--C 1.539 0.531 0 CA-C-O 121.447 0.641 . . . . 71.420000000000002 111.878 -176.302 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.41 ' CH2' HD11 ' A' ' 100' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 N-CA-C 114.618 1.34 . . . . 63.030000000000001 114.618 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.508 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 51.6 m-85 -110.95 136.66 49.63 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.766 -1.561 . . . . 75.140000000000001 111.34 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 57' ' ' ILE . 51.1 mt -114.72 105.5 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.182 0.515 . . . . 72.319999999999993 109.62 171.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.506 ' O ' HG12 ' A' ' 82' ' ' ILE . 38.0 mtmt -96.19 133.1 40.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.996 0.427 . . . . 74.400000000000006 111.09 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.38 158.44 26.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.464 0.649 . . . . 72.140000000000001 112.702 -172.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 19.9 t70 -59.58 -37.48 78.61 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.263 -0.881 . . . . 71.310000000000002 110.976 171.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -170.7 152.86 3.88 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.866 -0.606 . . . . 64.530000000000001 110.787 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.416 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 68.0 mt -108.93 118.82 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.767 -0.652 . . . . 74.340000000000003 110.953 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -127.16 164.69 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 121.038 0.447 . . . . 71.150000000000006 112.071 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 90.6 mt -76.81 137.64 39.35 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.39 0.614 . . . . 73.010000000000005 112.236 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 115.924 -0.58 . . . . 75.010000000000005 110.375 174.756 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.4 mt . . . . . 0 N--CA 1.464 0.252 0 N-CA-C 110.055 -0.35 . . . . 75.400000000000006 110.055 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -102.79 123.31 46.23 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.302 0.573 . . . . 64.530000000000001 112.198 -176.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -67.49 143.57 56.12 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.253 -0.885 . . . . 61.5 111.456 -179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -123.53 -62.94 1.27 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.792 0.294 . . . . 72.519999999999996 111.792 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.61 164.14 36.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.248 0.547 . . . . 65.340000000000003 112.327 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.61 115.04 9.32 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.888 -0.596 . . . . 75.420000000000002 110.707 173.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 8.4 tpt180 -73.04 -59.72 2.57 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.948 0.404 . . . . 71.349999999999994 111.493 -176.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -161.92 139.68 8.82 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.043 0.386 . . . . 70.200000000000003 112.043 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -99.8 99.96 10.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.396 -0.594 . . . . 73.239999999999995 109.396 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' HB2' ' A' ' 42' ' ' LYS . 16.0 m -68.19 87.98 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.784 0.802 . . . . 63.43 111.254 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 46.8 mtt180 -82.07 155.91 24.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.884 -0.598 . . . . 61.119999999999997 111.825 -176.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.651 HG12 ' HE2' ' A' ' 42' ' ' LYS . 54.2 mt -68.63 107.47 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 115.862 -0.608 . . . . 70.409999999999997 111.829 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.45 112.61 20.53 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.034 0.445 . . . . 64.030000000000001 110.227 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -60.04 164.72 3.79 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.798 -0.637 . . . . 61.539999999999999 112.51 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.2 -32.07 64.05 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.304 0.573 . . . . 72.420000000000002 110.911 176.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.24 -8.22 43.89 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.633 -0.712 . . . . 74.319999999999993 111.865 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.04 -3.49 82.62 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.231 -0.509 . . . . 73.120000000000005 113.027 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.4 p -84.15 155.21 22.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.859 0.361 . . . . 71.209999999999994 111.479 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 43.9 t -95.74 124.31 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.885 0.374 . . . . 75.319999999999993 111.563 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 t -85.7 152.72 22.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.353 -0.385 . . . . 60.009999999999998 111.446 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.85 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.937 0.398 . . . . 64.140000000000001 111.029 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.85 143.05 58.2 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.244 0.545 . . . . 71.319999999999993 111.806 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 31.1 mt -113.06 145.93 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 116.192 -0.458 . . . . 73.049999999999997 111.672 -175.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HE2' HG12 ' A' ' 30' ' ' ILE . 73.9 mmtt -78.76 -50.66 10.99 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.233 0.539 . . . . 52.310000000000002 110.176 170.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.84 168.18 8.93 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.732 -0.667 . . . . 74.340000000000003 111.404 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.3 mtt180 -114.87 117.19 29.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.694 0.398 . . . . 74.340000000000003 112.032 -173.412 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.1 m -96.32 132.42 41.82 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.338 -0.392 . . . . 74.319999999999993 111.788 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -122.97 153.97 39.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.679 0.391 . . . . 62.219999999999999 111.659 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.424 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 61.4 m-20 -88.48 113.17 23.78 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.693 0.282 . . . . 64.299999999999997 111.664 175.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 59' ' ' VAL . 67.5 mt -113.19 122.14 46.6 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.011 0.434 . . . . 75.230000000000004 110.865 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HE2' ' HG3' ' A' ' 56' ' ' MET . 1.1 mptm? -94.5 141.12 28.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.094 0.474 . . . . 74.319999999999993 112.076 -178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.45 ' HB2' ' HG2' ' A' ' 55' ' ' ARG . 19.6 m . . . . . 0 N--CA 1.472 0.637 0 CA-C-N 115.786 -0.643 . . . . 74.099999999999994 110.514 175.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.45 ' HG2' ' HB2' ' A' ' 50' ' ' SER . 15.8 ptt180 . . . . . 0 N--CA 1.471 0.612 0 CA-C-O 121.213 0.53 . . . . 72.219999999999999 111.86 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.474 ' N ' ' SD ' ' A' ' 56' ' ' MET . 3.3 mpp? -111.8 108.4 17.79 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.824 -0.625 . . . . 74.109999999999999 110.055 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.5 pt -98.1 144.71 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.715 0.293 . . . . 72.0 111.091 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 87.4 mm-40 -97.48 105.05 17.13 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.055 0.455 . . . . 75.420000000000002 110.973 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.615 HG21 HD12 ' A' ' 48' ' ' LEU . 98.9 t -107.19 128.31 62.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 116.442 -0.345 . . . . 74.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 31.5 t -126.46 134.72 50.88 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.295 0.48 . . . . 63.329999999999998 112.295 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.6 pt -115.13 143.98 31.27 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 116.271 -0.422 . . . . 74.109999999999999 111.192 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.65 147.38 60.1 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.585 2.19 . . . . 74.099999999999994 113.193 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.03 -16.89 20.75 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.057 0.762 . . . . 45.439999999999998 113.057 -176.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 m -74.96 -4.53 38.73 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.025 0.38 . . . . 41.409999999999997 112.025 177.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.8 t -102.19 131.43 22.62 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 122.487 0.315 . . . . 74.400000000000006 111.201 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.99 146.03 17.91 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.003 2.468 . . . . 75.510000000000005 113.869 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.01 136.83 50.81 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.939 -0.573 . . . . 74.420000000000002 111.686 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -87.68 133.2 33.88 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.168 0.508 . . . . 75.420000000000002 112.12 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -117.9 30.92 6.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.644 -0.707 . . . . 64.299999999999997 111.161 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -64.54 161.39 17.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.637 0.606 . . . . 75.239999999999995 112.637 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -83.49 163.58 20.38 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.636 -0.711 . . . . 53.100000000000001 112.102 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -64.17 120.92 13.02 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.25 -0.432 . . . . 74.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 66.4 34.3 6.38 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 64.120000000000005 111.865 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.58 118.68 20.22 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.471 -0.331 . . . . 71.430000000000007 111.198 175.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -60.11 108.87 0.84 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.877 0.37 . . . . 63.43 111.663 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.483 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.85 169.75 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.407 0.622 . . . . 74.049999999999997 111.817 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.87 157.96 44.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.043 -0.526 . . . . 61.240000000000002 110.697 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 93.5 mt -102.65 126.55 49.79 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.944 0.35 . . . . 45.219999999999999 111.944 -175.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.471 HG22 ' OD1' ' A' ' 80' ' ' ASN . 50.2 mm -56.13 -59.99 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 116.266 -0.424 . . . . 73.329999999999998 111.622 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.528 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 28.1 m120 -137.03 91.56 14.82 Favored Pre-proline 0 N--CA 1.473 0.702 0 O-C-N 122.237 -0.289 . . . . 52.149999999999999 111.257 174.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.75 141.47 12.18 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.019 2.479 . . . . 73.510000000000005 113.615 176.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -141.78 131.26 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-O 121.042 0.449 . . . . 73.319999999999993 111.231 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.34 110.11 9.42 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.227 -0.296 . . . . 74.420000000000002 110.457 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.6 t70 . . . . . 0 CA--C 1.549 0.914 0 C-N-CA 121.2 -0.2 . . . . 74.319999999999993 111.264 -171.916 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 . . . . . 0 C--O 1.243 0.745 0 CA-C-O 121.384 0.612 . . . . 53.450000000000003 111.858 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.437 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -112.67 126.65 55.62 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.54 -0.755 . . . . 65.230000000000004 112.946 -171.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.429 ' HB ' HG22 ' A' ' 59' ' ' VAL . 57.3 mt -111.07 115.93 51.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.197 -0.91 . . . . 54.130000000000003 110.291 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -84.8 134.85 34.3 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.078 -0.389 . . . . 75.340000000000003 110.898 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.1 143.96 50.92 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.227 0.537 . . . . 54.020000000000003 112.165 -176.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.0 t70 -65.01 -40.03 94.31 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.884 -0.598 . . . . 72.209999999999994 111.422 176.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.453 ' HB3' HG13 ' A' ' 79' ' ' ILE . 22.1 t0 -170.42 161.61 8.03 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 116.383 -0.371 . . . . 75.530000000000001 110.817 178.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 36.5 mt -122.66 122.13 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 116.527 -0.306 . . . . 74.120000000000005 111.302 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.7 m -126.35 176.57 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.64 0.257 . . . . 72.329999999999998 111.026 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.483 HD23 HG12 ' A' ' 76' ' ' VAL . 97.2 mt -76.05 145.41 40.17 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.176 -0.327 . . . . 63.140000000000001 111.417 177.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.595 0.236 . . . . 61.049999999999997 110.873 177.764 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.6 mt . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.094 -0.336 . . . . 53.530000000000001 110.094 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD2' ' O ' ' A' ' 73' ' ' ASN . 46.9 mtmt -132.83 138.81 47.2 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 122.036 -0.415 . . . . 73.310000000000002 112.027 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -70.2 140.03 52.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.057 0.391 . . . . 70.329999999999998 112.057 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 94.8 p -125.97 -62.39 1.18 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.011 0.374 . . . . 75.129999999999995 112.011 177.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -149.98 -173.6 4.48 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.494 0.553 . . . . 73.319999999999993 112.494 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 tp -104.85 123.79 48.32 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.237 -0.438 . . . . 74.140000000000001 110.754 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -73.16 -64.75 0.91 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.095 0.406 . . . . 73.5 112.095 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -170.16 143.45 2.44 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.071 0.462 . . . . 72.120000000000005 111.905 -174.411 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.433 ' HG2' ' HG3' ' A' ' 44' ' ' ARG . 43.3 mt-10 -106.13 108.96 20.75 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.18 -0.464 . . . . 74.530000000000001 110.481 173.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -85.95 110.05 19.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 121.304 0.573 . . . . 64.230000000000004 111.17 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.682 ' HG2' HG12 ' A' ' 41' ' ' ILE . 73.7 mtm180 -99.9 178.48 4.8 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.474 0.654 . . . . 63.119999999999997 112.761 -174.13 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.06 124.17 39.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.496 -0.774 . . . . 71.5 110.639 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -98.35 133.78 42.28 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.999 0.428 . . . . 74.430000000000007 111.698 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -68.94 143.72 54.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.249 -0.432 . . . . 72.409999999999997 110.741 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.59 -17.68 48.02 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.139 0.495 . . . . 75.109999999999999 111.636 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.12 -39.75 71.86 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.069 0.461 . . . . 75.030000000000001 111.253 174.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.5 -46.22 0.82 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.372 -0.442 . . . . 73.439999999999998 112.916 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.2 p -61.46 160.79 10.42 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 120.991 0.424 . . . . 35.530000000000001 111.931 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.4 t -107.97 136.89 41.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-O 121.024 0.44 . . . . 75.109999999999999 111.793 -177.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 t -79.83 168.88 18.7 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.272 0.558 . . . . 73.439999999999998 111.895 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.42 -26.74 55.82 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 111.813 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 142.69 57.94 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.268 0.556 . . . . 53.539999999999999 111.453 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.682 HG12 ' HG2' ' A' ' 29' ' ' ARG . 24.1 mt -115.48 145.04 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 116.066 -0.516 . . . . 54.25 111.934 -172.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -78.58 -57.79 3.59 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.146 0.498 . . . . 72.439999999999998 110.389 173.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.44 167.75 25.02 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.157 0.503 . . . . 64.400000000000006 111.478 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.433 ' HG3' ' HG2' ' A' ' 27' ' ' GLU . 44.8 ttm180 -125.51 123.71 39.76 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.927 0.394 . . . . 72.349999999999994 111.752 -172.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 16.9 m -102.3 128.84 48.68 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 116.2 -0.455 . . . . 75.5 112.175 -177.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -109.9 160.26 16.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.71 0.404 . . . . 74.319999999999993 111.369 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.05 124.1 42.39 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.186 -0.461 . . . . 75.439999999999998 110.476 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.439 ' HB2' HG13 ' A' ' 57' ' ' ILE . 73.3 mt -123.52 130.32 52.51 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.151 0.5 . . . . 74.230000000000004 111.535 178.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.418 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 1.8 mmmp? -80.77 128.57 33.79 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.444 -0.344 . . . . 75.430000000000007 110.64 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.235 0.458 . . . . 61.219999999999999 112.235 -175.546 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 120.825 0.345 . . . . 71.109999999999999 110.935 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -108.55 177.62 4.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.691 0.281 . . . . 72.430000000000007 110.492 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.439 HG13 ' HB2' ' A' ' 48' ' ' LEU . 36.4 pt -131.62 138.24 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.962 0.41 . . . . 44.439999999999998 111.81 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -104.74 105.68 15.86 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.033 0.444 . . . . 74.109999999999999 110.622 175.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 93.5 t -100.07 126.59 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.308 0.484 . . . . 51.200000000000003 112.308 -173.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 14.3 t -114.03 123.07 48.78 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.712 0.291 . . . . 65.019999999999996 111.749 -176.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 pt -114.03 155.1 45.85 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.543 -0.299 . . . . 74.319999999999993 111.368 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.27 138.73 80.23 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 122.778 2.319 . . . . 73.239999999999995 113.297 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.74 -13.81 62.43 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.668 0.618 . . . . 73.120000000000005 112.668 -176.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.1 m -73.83 0.67 12.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 120.938 0.399 . . . . 71.519999999999996 111.169 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 94.5 t -101.77 129.96 25.52 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 122.816 0.446 . . . . 74.230000000000004 110.849 176.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.46 156.18 27.5 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.658 2.239 . . . . 74.120000000000005 113.438 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.553 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 39.7 tp -69.45 145.75 52.53 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.088 -0.506 . . . . 71.109999999999999 111.563 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.488 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 13.5 mptt -93.62 -66.13 0.94 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.986 0.736 . . . . 51.329999999999998 112.986 -176.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.1 mt-10 60.88 49.28 6.09 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.861 0.319 . . . . 65.439999999999998 111.861 -177.186 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.51 176.41 1.11 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.479 0.657 . . . . 63.310000000000002 112.644 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 16.7 m-20 -71.77 153.85 41.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.703 -0.68 . . . . 73.329999999999998 111.843 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -67.49 119.57 12.52 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.95 -0.568 . . . . 70.230000000000004 111.263 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 40.5 m-80 61.97 34.33 16.8 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.584 0.587 . . . . 74.319999999999993 112.584 -177.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -88.03 142.18 27.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.719 -0.219 . . . . 73.019999999999996 111.142 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -62.18 115.96 4.58 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.383 0.611 . . . . 63.5 112.388 179.837 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HD23 ' A' ' 107' ' ' LEU . 33.5 m -125.31 146.94 30.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.587 -0.733 . . . . 71.420000000000002 111.208 177.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -125.65 162.99 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.313 0.577 . . . . 73.219999999999999 111.316 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 59' ' ' VAL . 86.7 mt -110.17 137.67 47.59 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.226 -0.443 . . . . 75.219999999999999 111.731 -176.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -67.11 -68.42 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 116.286 -0.416 . . . . 65.109999999999999 110.925 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 102' ' ' ALA . 80.9 m-20 -122.72 85.99 49.56 Favored Pre-proline 0 N--CA 1.473 0.693 0 CA-C-N 116.679 -0.237 . . . . 75.019999999999996 111.191 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.73 129.81 6.52 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.808 2.339 . . . . 64.430000000000007 113.449 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.8 pt -137.86 130.97 41.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 121.162 0.506 . . . . 70.230000000000004 111.046 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.66 127.65 32.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.775 0.321 . . . . 72.510000000000005 111.425 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 112.152 0.427 . . . . 72.510000000000005 112.152 -178.709 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 CA--C 1.543 0.699 0 CA-C-O 121.651 0.739 . . . . 73.530000000000001 112.607 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.2 138.93 34.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.483 -0.78 . . . . 63.119999999999997 112.061 -178.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 50.5 mt -124.67 114.64 41.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 115.724 -0.671 . . . . 74.200000000000003 110.142 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -83.4 139.12 33.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.068 -0.395 . . . . 64.209999999999994 110.387 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 80' ' ' ASN . . . -141.16 160.49 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.29 0.566 . . . . 54.039999999999999 112.39 -175.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.426 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 34.7 t70 -63.01 -55.39 26.04 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.606 -0.725 . . . . 60.109999999999999 110.986 175.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -163.19 164.85 25.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.11 -0.495 . . . . 74.239999999999995 110.896 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.488 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 52.3 mt -115.04 117.34 55.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.087 0.555 . . . . 74.219999999999999 111.234 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.34 175.28 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.154 -0.341 . . . . 74.540000000000006 111.425 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.401 HD23 HG12 ' A' ' 76' ' ' VAL . 96.4 mt -77.12 138.13 39.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.723 0.297 . . . . 74.219999999999999 111.45 178.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.5 m . . . . . 0 N--CA 1.469 0.525 0 CA-C-O 120.902 0.382 . . . . 60.43 111.758 -179.124 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 95.3 mt . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 120.773 0.32 . . . . 63.299999999999997 110.58 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HB2' ' HD3' ' A' ' 49' ' ' LYS . 57.6 mttp -112.78 130.77 55.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.911 0.386 . . . . 61.409999999999997 111.387 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.85 132.39 48.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.92 -0.582 . . . . 63.119999999999997 111.207 177.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 m -116.75 -64.31 1.33 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.894 0.378 . . . . 72.519999999999996 111.607 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.68 -175.41 5.14 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.06 0.457 . . . . 70.439999999999998 111.894 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -105.89 107.24 18.14 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.166 -0.47 . . . . 72.400000000000006 110.127 175.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -59.01 -52.88 63.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.547 0.573 . . . . 73.329999999999998 112.547 -174.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -174.42 134.93 0.41 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.77 0.656 . . . . 51.219999999999999 112.77 -174.049 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -105.18 106.16 16.53 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.34 -0.391 . . . . 73.040000000000006 110.351 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -78.36 113.1 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.066 0.46 . . . . 72.329999999999998 111.505 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.645 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 96.0 mtt180 -79.95 161.96 25.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.278 0.561 . . . . 74.549999999999997 112.375 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -77.01 105.5 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 115.721 -0.672 . . . . 74.0 111.267 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.437 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 64.4 tt0 -77.85 121.18 23.76 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.891 0.377 . . . . 72.439999999999998 111.23 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -65.84 147.21 53.74 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.942 0.401 . . . . 74.109999999999999 111.574 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -63.33 -13.96 44.66 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.122 -0.49 . . . . 74.200000000000003 111.465 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.51 -23.93 61.08 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.049 0.452 . . . . 74.319999999999993 111.342 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.75 -42.87 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.442 -0.408 . . . . 72.209999999999994 112.97 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.0 m -74.5 159.88 31.66 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.093 0.473 . . . . 73.120000000000005 111.903 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 50.1 t -92.59 137.08 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.889 0.376 . . . . 55.329999999999998 111.527 -178.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.8 t -79.64 179.67 7.37 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.396 0.617 . . . . 73.340000000000003 111.884 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -78.49 -44.95 23.23 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.034 -0.53 . . . . 74.209999999999994 110.997 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -72.82 157.6 37.16 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.244 0.831 . . . . 62.520000000000003 113.244 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 34.2 mt -104.06 152.44 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.442 -0.799 . . . . 53.329999999999998 111.699 -176.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -91.95 -58.34 2.43 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.045 0.45 . . . . 73.530000000000001 111.254 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -153.97 160.66 42.16 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 120.882 0.372 . . . . 65.109999999999999 111.217 176.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 44' ' ' ARG . 5.5 ptp85 -125.63 126.44 44.73 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.563 0.579 . . . . 54.299999999999997 112.563 -174.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 88.8 m -96.6 129.12 44.05 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.735 -0.666 . . . . 65.319999999999993 111.991 -178.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' OH ' HD12 ' A' ' 67' ' ' LEU . 66.1 m-85 -107.82 163.53 13.04 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 121.23 0.538 . . . . 71.299999999999997 112.138 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -106.94 108.35 19.82 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.58 -0.736 . . . . 73.519999999999996 111.472 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.9 mt -122.64 125.92 46.6 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 122.29 -0.256 . . . . 74.409999999999997 110.895 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HD3' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -94.11 134.48 36.5 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.87 -0.518 . . . . 70.439999999999998 112.022 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.472 0.664 0 CA-C-N 116.149 -0.478 . . . . 71.049999999999997 111.442 -178.789 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 . . . . . 0 N--CA 1.469 0.477 0 CA-C-O 121.195 0.521 . . . . 73.120000000000005 111.942 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.476 ' SD ' ' N ' ' A' ' 56' ' ' MET . 1.5 pmm? -102.14 147.69 26.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.857 -0.611 . . . . 72.310000000000002 111.377 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.8 pt -103.52 137.82 30.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 111.025 177.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -93.45 104.68 16.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.182 -0.463 . . . . 70.420000000000002 110.394 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -105.36 112.43 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.813 0.34 . . . . 64.310000000000002 111.728 -175.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 98.2 p -103.91 130.74 51.54 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.269 0.557 . . . . 72.319999999999993 111.874 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -125.21 152.36 70.81 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 111.095 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.78 142.54 41.38 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.716 2.277 . . . . 73.400000000000006 113.508 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.52 -30.81 69.97 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.925 0.393 . . . . 52.140000000000001 111.966 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.9 t -61.08 -22.74 64.9 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.087 0.47 . . . . 74.439999999999998 111.306 176.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.83 127.81 84.76 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 116.462 -0.336 . . . . 55.329999999999998 110.547 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.38 144.01 92.56 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.917 2.411 . . . . 74.430000000000007 113.741 -175.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.441 HD12 ' OH ' ' A' ' 46' ' ' TYR . 24.3 tp -60.45 146.71 43.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.468 -0.787 . . . . 63.299999999999997 110.608 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 68' ' ' LYS . 3.6 mptp? -88.09 -56.79 3.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.95 0.722 . . . . 63.210000000000001 112.95 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 59.65 21.95 10.65 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.569 0.581 . . . . 73.030000000000001 112.569 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.21 164.98 14.64 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.2 0.524 . . . . 51.43 112.172 -177.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -65.1 146.91 54.37 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.432 0.634 . . . . 60.310000000000002 112.568 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.09 123.94 19.49 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.434 -0.803 . . . . 73.439999999999998 111.627 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 71.03 16.71 6.36 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.21 0.604 . . . . 64.430000000000007 112.53 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.21 149.06 32.03 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.149 -0.344 . . . . 75.109999999999999 111.09 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.56 123.85 22.38 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.911 0.386 . . . . 74.519999999999996 111.427 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.462 HG12 HD23 ' A' ' 107' ' ' LEU . 30.4 m -127.21 140.47 49.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 121.052 0.453 . . . . 63.140000000000001 111.075 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -123.73 153.33 41.04 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.202 0.525 . . . . 72.510000000000005 111.151 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.422 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.7 mt -93.61 146.46 23.8 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.195 -0.457 . . . . 71.549999999999997 111.732 -177.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -77.0 -67.32 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.24 -0.436 . . . . 62.229999999999997 111.005 176.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.408 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 25.9 m120 -124.42 88.19 53.4 Favored Pre-proline 0 N--CA 1.473 0.714 0 O-C-N 122.2 -0.312 . . . . 61.039999999999999 110.838 174.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.409 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . 85.8 Cg_endo -82.32 128.52 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.946 2.431 . . . . 73.430000000000007 113.868 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.6 pt -137.58 123.83 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.166 0.508 . . . . 62.439999999999998 111.02 171.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 142.42 48.79 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 122.121 -0.362 . . . . 74.129999999999995 110.381 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 t70 . . . . . 0 CA--C 1.537 0.465 0 CA-C-O 121.317 0.58 . . . . 73.409999999999997 112.095 -175.982 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 . . . . . 0 N--CA 1.47 0.574 0 CA-C-O 121.101 0.477 . . . . 74.230000000000004 111.63 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -111.05 128.65 55.93 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.029 0.751 . . . . 61.219999999999999 113.029 -171.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 66.4 mt -120.57 128.36 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.279 -0.873 . . . . 72.109999999999999 110.527 177.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.35 131.4 42.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.905 0.383 . . . . 74.299999999999997 110.278 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.65 162.92 24.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.513 0.673 . . . . 72.530000000000001 112.605 -176.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 26.8 t70 -78.3 -40.55 36.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.19 -0.914 . . . . 62.409999999999997 111.425 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -169.44 155.89 6.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.003 0.43 . . . . 73.349999999999994 111.46 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.454 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 31.7 mt -120.92 118.68 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 115.892 -0.595 . . . . 74.450000000000003 110.722 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.9 m -122.75 168.93 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 120.934 0.397 . . . . 73.010000000000005 111.626 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.462 HD23 HG12 ' A' ' 76' ' ' VAL . 69.2 mt -74.73 133.57 42.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.809 0.338 . . . . 71.439999999999998 111.494 176.275 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.534 0.339 0 CA-C-N 116.475 -0.33 . . . . 71.219999999999999 110.381 176.255 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 96.8 mt . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.831 0.348 . . . . 73.530000000000001 111.306 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.518 ' HE2' ' N ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -102.62 112.93 25.9 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.483 -0.326 . . . . 75.120000000000005 111.075 176.87 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.453 ' HE1' ' CD1' ' A' ' 46' ' ' TYR . 86.0 t80 -78.82 113.25 16.74 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.254 -0.43 . . . . 73.25 111.742 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.6 p -101.19 -60.09 1.59 Allowed 'General case' 0 N--CA 1.474 0.741 0 O-C-N 122.109 -0.37 . . . . 70.219999999999999 111.919 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.16 173.95 15.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.91 0.707 . . . . 42.240000000000002 112.91 -178.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -92.65 116.65 29.2 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.525 -0.761 . . . . 73.420000000000002 110.984 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 19.3 tpt180 -71.51 -54.61 10.0 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.405 0.52 . . . . 72.239999999999995 112.405 -173.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -164.7 146.9 8.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.081 0.467 . . . . 75.25 111.922 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.4 mt-10 -114.03 99.39 7.61 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.018 -0.537 . . . . 64.209999999999994 110.501 175.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -71.91 120.57 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.358 0.599 . . . . 70.340000000000003 110.702 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.2 mtt180 -98.16 165.94 11.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.349 0.595 . . . . 64.040000000000006 112.301 -173.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.9 mt -69.34 112.51 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.659 -0.7 . . . . 72.140000000000001 111.319 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 58.3 tt0 -86.51 120.18 27.56 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.14 -0.482 . . . . 60.549999999999997 110.838 -178.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.05 173.7 5.25 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.132 0.79 . . . . 74.439999999999998 113.132 -174.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -53.98 -41.5 67.97 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.55 -0.75 . . . . 65.109999999999999 112.344 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.7 -26.93 68.88 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.068 0.461 . . . . 72.340000000000003 112.053 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.14 -15.97 30.34 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.07 -0.586 . . . . 25.140000000000001 111.788 -171.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 m -72.14 137.84 47.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.006 0.431 . . . . 40.140000000000001 110.9 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.6 t -82.08 144.31 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-N 116.372 -0.377 . . . . 73.25 111.876 -175.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.8 t -95.3 176.44 6.21 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.915 0.388 . . . . 54.329999999999998 111.794 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -80.11 -29.87 39.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.943 0.401 . . . . 73.540000000000006 111.252 177.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.03 138.97 58.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.277 -0.42 . . . . 71.109999999999999 111.031 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.3 mt -101.81 147.93 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 112.059 0.392 . . . . 52.420000000000002 112.059 -175.085 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -94.74 -57.31 2.5 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 116.535 -0.302 . . . . 63.119999999999997 110.87 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -152.26 165.7 34.07 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.986 0.422 . . . . 64.129999999999995 111.857 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.54 ' HD3' HD13 ' A' ' 67' ' ' LEU . 64.9 mtt180 -128.8 137.66 51.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.932 0.396 . . . . 73.430000000000007 112.049 -172.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.4 m -113.57 132.49 55.7 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.369 -0.378 . . . . 62.340000000000003 111.936 -177.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.514 ' OH ' HD12 ' A' ' 67' ' ' LEU . 51.5 m-85 -109.6 157.67 18.8 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 120.774 0.321 . . . . 74.310000000000002 111.751 178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.42 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 55.3 m-20 -92.45 106.77 18.7 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.295 -0.411 . . . . 74.409999999999997 110.233 169.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.455 HD12 HG21 ' A' ' 59' ' ' VAL . 58.9 mt -115.45 134.08 55.43 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.146 0.498 . . . . 71.530000000000001 111.846 -178.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -93.96 128.74 40.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.162 -0.472 . . . . 72.409999999999997 111.003 177.81 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 61.5 p . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 112.479 0.548 . . . . 53.219999999999999 112.479 -175.761 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 121.412 0.625 . . . . 71.430000000000007 111.938 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.8 OUTLIER -87.72 125.12 34.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.449 -0.796 . . . . 74.030000000000001 110.86 176.981 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 100' ' ' ILE . 27.0 pt -125.5 141.12 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.975 0.417 . . . . 75.030000000000001 111.823 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 22.1 mp0 -95.68 105.93 17.98 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.989 0.424 . . . . 62.219999999999999 111.325 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 100' ' ' ILE . 93.4 t -100.01 128.47 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.652 0.263 . . . . 72.409999999999997 111.218 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 22.6 t -118.33 138.96 52.04 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.325 0.491 . . . . 73.310000000000002 112.325 -174.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.429 HG21 HG13 ' A' ' 105' ' ' ILE . 44.7 pt -133.76 149.01 70.74 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.282 -0.417 . . . . 71.25 111.109 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.44 145.48 94.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.433 2.089 . . . . 72.010000000000005 113.125 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -6.07 19.53 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.975 0.417 . . . . 64.420000000000002 112.073 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 55.3 p -74.02 -20.83 60.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.183 0.516 . . . . 74.340000000000003 110.679 172.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.6 t -89.78 124.8 62.93 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 115.849 -0.614 . . . . 73.200000000000003 110.864 177.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -49.73 126.42 16.44 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.813 2.342 . . . . 75.540000000000006 113.448 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.612 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 29.4 tp -56.75 126.32 26.34 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.106 -0.497 . . . . 64.109999999999999 111.074 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -69.72 -63.07 1.15 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.923 0.712 . . . . 74.340000000000003 112.923 -170.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.612 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 36.7 mt-10 56.25 45.61 22.79 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.757 0.651 . . . . 62.200000000000003 112.757 176.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -75.6 -169.17 0.98 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.824 0.345 . . . . 73.040000000000006 111.854 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -74.94 164.73 26.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.627 0.603 . . . . 64.450000000000003 112.627 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -70.92 125.4 26.73 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.863 -0.608 . . . . 72.109999999999999 111.113 -178.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 59.16 31.54 21.35 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 122.854 0.462 . . . . 71.120000000000005 111.878 -175.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.65 150.8 30.84 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.517 -0.31 . . . . 75.540000000000006 111.518 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.463 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 99.3 mtt180 -68.49 106.19 2.47 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.299 0.481 . . . . 73.120000000000005 112.299 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 35.7 m -123.2 141.65 42.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.422 -0.354 . . . . 75.340000000000003 111.095 174.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -128.82 164.71 22.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.333 0.587 . . . . 75.329999999999998 111.391 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.454 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.5 mt -102.24 136.65 41.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.968 -0.56 . . . . 62.409999999999997 112.025 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.425 HG22 ' OD1' ' A' ' 80' ' ' ASN . 49.7 mm -70.96 -76.14 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.184 -0.462 . . . . 72.230000000000004 111.417 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.425 ' OD1' HG22 ' A' ' 79' ' ' ILE . 24.6 m120 -121.25 85.39 41.88 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.171 -0.33 . . . . 61.420000000000002 110.525 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -82.46 149.07 14.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.113 2.542 . . . . 51.409999999999997 114.703 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.7 pt -128.58 139.69 51.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.171 0.51 . . . . 73.549999999999997 110.122 168.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.66 105.75 17.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.286 -0.416 . . . . 71.519999999999996 111.859 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 121.293 0.568 . . . . 74.319999999999993 112.023 -179.861 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 . . . . . 0 C--O 1.236 0.39 0 CA-C-O 121.172 0.51 . . . . 72.319999999999993 112.238 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.433 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 76.2 m-85 -105.16 154.22 20.48 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.749 -0.66 . . . . 70.340000000000003 112.253 -177.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 57' ' ' ILE . 66.7 mt -135.85 107.39 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.427 -0.806 . . . . 64.200000000000003 109.76 175.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.3 mtpp -86.13 120.88 27.99 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.363 0.601 . . . . 72.239999999999995 111.101 -177.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.09 144.33 43.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.098 0.475 . . . . 71.040000000000006 112.165 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -56.31 -44.38 79.84 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.895 -0.593 . . . . 73.150000000000006 111.133 173.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -165.34 158.09 15.82 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.162 -0.472 . . . . 75.329999999999998 110.95 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.485 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 23.8 mt -123.43 122.46 65.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.093 -0.503 . . . . 60.340000000000003 110.915 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.5 m -124.62 177.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.608 0.242 . . . . 62.32 111.261 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.4 mt -76.96 137.91 39.33 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 122.411 -0.181 . . . . 74.510000000000005 110.792 174.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 32.5 m . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 120.755 0.312 . . . . 42.210000000000001 111.296 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.3 mt . . . . . 0 N--CA 1.467 0.377 0 N-CA-C 110.291 -0.263 . . . . 72.209999999999994 110.291 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -127.84 133.47 49.38 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.146 0.498 . . . . 73.140000000000001 112.312 -178.263 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.494 ' HE1' ' HD2' ' A' ' 46' ' ' TYR . 65.7 t80 -77.84 114.75 17.0 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.719 -0.673 . . . . 74.450000000000003 111.555 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.7 m -97.39 -62.83 1.2 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.875 0.324 . . . . 64.329999999999998 111.875 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.21 171.08 20.85 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.465 0.543 . . . . 72.450000000000003 112.465 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -83.2 134.66 34.95 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.936 -0.574 . . . . 75.329999999999998 110.847 176.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -86.65 -58.74 2.49 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.646 0.26 . . . . 64.400000000000006 111.663 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 26' ' ' ARG . 31.4 ttm180 -172.65 137.14 0.78 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.115 0.413 . . . . 64.439999999999998 112.115 -178.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -94.83 109.06 21.08 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.316 -0.402 . . . . 73.310000000000002 110.066 172.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.0 m -77.81 120.74 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 121.12 0.486 . . . . 72.349999999999994 111.31 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.454 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 62.6 mtm180 -104.44 -178.46 3.66 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.403 0.621 . . . . 73.049999999999997 112.293 -174.417 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.507 HG12 ' HE2' ' A' ' 42' ' ' LYS . 52.8 mt -99.42 118.85 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.909 -0.587 . . . . 64.150000000000006 111.806 -175.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 53.9 tt0 -85.51 118.19 24.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.055 0.455 . . . . 64.040000000000006 110.825 175.042 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.9 m-20 -74.29 167.54 21.42 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.959 0.725 . . . . 71.340000000000003 112.959 -172.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.49 -11.38 60.64 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.849 -0.614 . . . . 70.319999999999993 111.065 176.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -68.69 -32.02 71.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.281 0.562 . . . . 72.019999999999996 110.788 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.09 -33.26 5.11 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 115.859 -0.609 . . . . 64.329999999999998 111.952 -174.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.8 p -81.28 158.88 24.63 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.087 0.47 . . . . 64.030000000000001 111.27 176.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 38.3 t -93.66 125.02 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 120.712 0.291 . . . . 72.0 111.78 -177.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.448 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 41.0 t -65.77 152.71 43.7 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.094 0.473 . . . . 73.209999999999994 111.407 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.454 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 6.0 m-20 -77.45 -1.87 32.47 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.154 0.502 . . . . 61.130000000000003 111.064 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.9 142.48 45.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.137 -0.483 . . . . 73.030000000000001 110.682 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.428 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 62.5 mt -108.27 143.47 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.066 0.46 . . . . 74.450000000000003 112.079 -173.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HE2' HG12 ' A' ' 30' ' ' ILE . 69.7 mmtt -88.29 -58.63 2.49 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.072 0.463 . . . . 71.040000000000006 110.616 171.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -145.06 171.47 14.44 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.013 -0.539 . . . . 72.439999999999998 111.078 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 44' ' ' ARG . 45.7 ttm105 -134.07 114.81 13.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.435 -0.348 . . . . 54.119999999999997 111.386 -176.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.1 m -97.47 128.41 44.22 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.491 0.552 . . . . 61.329999999999998 112.491 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.494 ' HD2' ' HE1' ' A' ' 21' ' ' PHE . 80.1 m-85 -110.68 158.05 19.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.24 0.616 . . . . 74.450000000000003 111.365 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -99.94 107.22 19.14 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.525 -0.307 . . . . 73.040000000000006 110.484 170.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.9 mt -109.63 121.78 45.98 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.79 0.329 . . . . 72.329999999999998 110.849 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -76.05 144.39 40.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.07 0.462 . . . . 71.329999999999998 111.376 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 34.2 m . . . . . 0 N--CA 1.468 0.472 0 CA-C-N 116.075 -0.511 . . . . 72.510000000000005 111.222 -177.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 50' ' ' SER . 11.7 ptm180 . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.621 0.248 . . . . 65.439999999999998 110.46 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -95.67 -179.55 4.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.978 0.418 . . . . 75.530000000000001 111.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.539 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 30.7 pt -126.65 138.11 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 116.266 -0.424 . . . . 74.340000000000003 111.194 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -102.46 107.72 18.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.717 -0.614 . . . . 73.209999999999994 110.86 176.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.629 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 97.9 t -100.38 125.46 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.8 0.667 . . . . 63.210000000000001 112.8 -172.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -108.05 127.78 54.09 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.039 0.447 . . . . 61.439999999999998 111.315 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.415 HD12 ' HB ' ' A' ' 65' ' ' VAL . 37.0 pt -113.58 151.98 45.01 Favored Pre-proline 0 N--CA 1.473 0.675 0 CA-C-N 116.465 -0.334 . . . . 74.140000000000001 111.0 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.6 154.4 73.94 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.195 1.93 . . . . 72.420000000000002 112.766 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.58 -18.81 8.33 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.363 0.505 . . . . 75.409999999999997 112.363 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.2 m -60.89 -19.67 60.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.795 0.438 . . . . 72.219999999999999 111.998 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 24.2 t -114.48 120.02 38.77 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 116.666 -0.243 . . . . 62.350000000000001 110.893 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 16.7 Cg_exo -68.49 -172.43 0.45 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.033 2.489 . . . . 74.0 113.799 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.6 tp -72.1 147.41 46.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.049 -0.523 . . . . 75.5 111.092 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.475 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.9 mptp? -94.89 111.82 23.58 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.028 0.442 . . . . 54.219999999999999 111.388 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -80.74 65.03 5.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.205 0.526 . . . . 53.140000000000001 111.061 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -98.22 166.85 11.2 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.636 0.731 . . . . 70.310000000000002 112.304 -177.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.467 ' HB3' ' HB2' ' A' ' 74' ' ' ALA . 24.8 t70 -74.53 149.05 40.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.299 -0.864 . . . . 71.239999999999995 111.462 178.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.2 122.62 16.59 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.023 0.439 . . . . 65.150000000000006 111.642 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 64.07 30.23 13.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.1 0.56 . . . . 73.129999999999995 111.89 -177.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 71' ' ' ASP . . . -80.59 151.33 29.14 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.719 0.295 . . . . 31.329999999999998 111.352 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -66.96 125.1 24.89 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.639 -0.255 . . . . 73.349999999999994 111.473 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.61 152.33 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 121.14 0.495 . . . . 64.439999999999998 112.007 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -137.69 169.52 17.64 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.858 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -107.79 155.02 20.69 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.714 0.769 . . . . 72.340000000000003 113.053 -174.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.5 mm -111.2 116.28 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 115.156 -0.929 . . . . 61.509999999999998 109.522 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.1 m120 53.84 75.46 0.62 Allowed Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 122.645 0.378 . . . . 74.0 111.917 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.58 130.82 7.07 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.68 2.253 . . . . 55.539999999999999 114.104 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 101' ' ' LYS . 48.7 pt -132.68 161.01 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.355 -0.384 . . . . 73.420000000000002 110.909 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.85 140.52 37.01 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.806 -0.558 . . . . 54.310000000000002 111.303 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 . . . . . 0 CA--C 1.547 0.858 0 CA-C-O 120.952 0.406 . . . . 74.310000000000002 110.989 -177.835 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.539 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 122.538 1.161 . . . . 74.299999999999997 114.027 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -95.72 113.02 24.62 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.031 -1.441 . . . . 75.420000000000002 111.512 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 9.9 mt -96.11 165.46 2.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.544 -0.909 . . . . 73.510000000000005 108.544 172.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HB2' HG13 ' A' ' 82' ' ' ILE . 28.5 mtpt -140.27 163.84 31.69 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.567 -0.708 . . . . 70.129999999999995 110.762 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -154.34 156.01 36.13 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.054 0.454 . . . . 62.130000000000003 111.87 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -74.94 -21.96 58.87 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.061 -0.518 . . . . 73.519999999999996 110.29 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -171.24 160.88 6.41 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.168 0.509 . . . . 54.210000000000001 111.482 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.475 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 38.5 mt -127.34 123.59 62.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.154 -0.475 . . . . 65.239999999999995 110.814 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.3 m -128.75 -179.43 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 122.411 0.284 . . . . 73.400000000000006 111.125 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 98.0 mt -78.41 144.17 36.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.757 0.313 . . . . 71.409999999999997 111.142 176.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 120.924 0.392 . . . . 61.409999999999997 111.407 -179.301 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt . . . . . 0 CA--C 1.537 0.481 0 N-CA-C 110.303 -0.258 . . . . 75.209999999999994 110.303 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -123.23 114.73 20.65 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.844 -0.535 . . . . 74.329999999999998 111.607 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -63.75 132.12 49.99 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.258 0.466 . . . . 71.120000000000005 112.258 -176.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.9 t -109.15 -65.01 1.18 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.131 0.419 . . . . 73.329999999999998 112.131 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.49 173.68 15.21 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.117 0.484 . . . . 63.210000000000001 112.06 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.2 tp -88.37 117.28 27.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.318 -0.401 . . . . 74.25 110.411 173.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -72.69 -62.38 1.47 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.969 0.414 . . . . 74.129999999999995 112.026 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -170.1 143.7 2.52 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.058 -0.519 . . . . 64.109999999999999 111.562 -175.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.0 mt-10 -105.23 103.66 13.24 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.375 -0.602 . . . . 65.510000000000005 109.375 170.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.537 HG23 ' HB2' ' A' ' 42' ' ' LYS . 15.9 m -67.25 102.03 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.587 0.708 . . . . 71.099999999999994 110.876 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 98.9 mtt180 -98.52 158.31 15.68 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.719 0.637 . . . . 70.010000000000005 112.719 -171.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.5 mt -69.02 109.3 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.586 -0.733 . . . . 70.200000000000003 112.076 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.0 tt0 -86.85 124.52 33.17 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.904 0.383 . . . . 73.109999999999999 110.332 174.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -70.43 155.44 40.69 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.795 0.331 . . . . 73.409999999999997 111.728 -178.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -23.71 62.72 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.407 0.623 . . . . 74.310000000000002 110.666 169.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.1 -28.06 64.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.652 -0.704 . . . . 71.040000000000006 111.499 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.81 -36.6 4.02 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 116.26 -0.427 . . . . 50.32 112.456 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.3 p -71.33 150.64 44.92 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 50.200000000000003 111.817 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 22.8 t -92.37 145.92 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.158 -0.474 . . . . 65.319999999999993 111.078 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.2 t -101.7 163.4 12.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.111 0.482 . . . . 62.43 111.835 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -77.54 -18.1 57.3 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.986 -0.552 . . . . 64.230000000000004 111.141 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.72 132.1 45.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.279 -0.419 . . . . 73.040000000000006 110.086 173.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 26.2 mt -109.84 147.47 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 112.069 0.396 . . . . 52.109999999999999 112.069 -169.103 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HB2' HG23 ' A' ' 28' ' ' VAL . 39.7 mmtm -74.56 -61.06 2.0 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.416 -0.587 . . . . 61.140000000000001 109.416 169.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -155.26 167.23 31.05 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.384 -0.825 . . . . 63.350000000000001 110.022 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.462 ' HD3' ' OH ' ' A' ' 46' ' ' TYR . 4.3 ptp85 -122.7 133.72 54.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.161 0.505 . . . . 73.319999999999993 112.157 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.5 m -107.52 124.93 50.63 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.858 -0.61 . . . . 74.150000000000006 112.474 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' OH ' ' HD3' ' A' ' 44' ' ' ARG . 79.7 m-85 -110.81 153.66 25.05 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 122.88 0.472 . . . . 74.239999999999995 111.143 176.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.64 114.33 26.25 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.324 -0.398 . . . . 72.129999999999995 111.06 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.543 HD12 HG21 ' A' ' 59' ' ' VAL . 47.4 mt -114.21 132.34 56.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.569 0.7 . . . . 73.5 111.77 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 49' ' ' LYS . 2.6 mmmp? -93.28 150.99 20.07 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.557 -0.747 . . . . 73.200000000000003 111.16 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.2 m . . . . . 0 N--CA 1.472 0.647 0 CA-C-O 120.871 0.367 . . . . 70.040000000000006 111.802 179.772 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.452 HH11 ' HD3' ' A' ' 55' ' ' ARG . 36.9 mtt180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 121.086 0.469 . . . . 75.219999999999999 111.119 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.9 ttt -128.43 148.63 50.72 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.975 -0.557 . . . . 65.109999999999999 110.763 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 pt -135.48 135.44 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.918 0.389 . . . . 73.349999999999994 111.28 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -98.11 105.73 17.92 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.109 0.48 . . . . 52.409999999999997 110.494 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.543 HG21 HD12 ' A' ' 48' ' ' LEU . 70.1 t -94.41 129.98 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.343 -0.389 . . . . 73.329999999999998 111.715 -174.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.5 ' O ' ' HA ' ' A' ' 101' ' ' LYS . 39.9 m -118.38 141.82 48.15 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.944 0.402 . . . . 73.549999999999997 111.292 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.1 pt -131.24 150.97 78.0 Favored Pre-proline 0 CA--C 1.539 0.525 0 O-C-N 122.305 -0.247 . . . . 72.299999999999997 110.928 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HG2' HG23 ' A' ' 65' ' ' VAL . 12.2 Cg_endo -55.76 146.13 68.09 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.481 2.12 . . . . 73.200000000000003 112.974 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.49 -28.49 59.94 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.678 0.621 . . . . 43.25 112.678 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.0 m -62.23 -26.5 68.41 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.079 0.4 . . . . 63.409999999999997 112.079 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.471 HG23 ' HG2' ' A' ' 62' ' ' PRO . 51.0 t -79.01 125.05 84.48 Favored Pre-proline 0 CA--C 1.544 0.723 0 CA-C-N 116.841 -0.163 . . . . 52.0 110.996 179.161 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -64.73 161.35 36.3 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.408 . . . . 73.200000000000003 114.416 -174.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.7 tp -67.61 138.16 56.19 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.835 -0.621 . . . . 73.040000000000006 111.224 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.4 mptp? -81.84 -48.98 10.89 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.266 0.839 . . . . 74.420000000000002 113.266 -173.695 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 63.77 21.59 12.73 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.834 0.679 . . . . 73.129999999999995 112.834 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -64.66 159.5 21.9 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.009 0.433 . . . . 61.219999999999999 111.865 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 4.9 m-20 -68.06 154.22 42.1 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.409 0.623 . . . . 72.109999999999999 112.512 -177.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -65.02 133.53 51.88 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.718 -0.673 . . . . 73.040000000000006 111.178 174.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 63.3 19.54 11.74 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.189 0.596 . . . . 73.099999999999994 112.481 -177.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -82.22 153.65 25.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.156 0.428 . . . . 50.210000000000001 112.156 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.529 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 65.4 mtt85 -70.77 104.35 2.86 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.954 -0.566 . . . . 33.210000000000001 112.111 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.443 HG12 HD23 ' A' ' 107' ' ' LEU . 31.8 m -120.13 153.06 23.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.099 -0.5 . . . . 75.129999999999995 111.273 177.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -145.92 173.49 12.1 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.131 0.491 . . . . 73.439999999999998 111.064 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HG11 ' A' ' 59' ' ' VAL . 81.8 mt -112.18 132.17 55.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.061 0.457 . . . . 52.329999999999998 111.981 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.449 HG22 ' OD1' ' A' ' 80' ' ' ASN . 48.5 mm -65.04 -59.54 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 115.916 -0.584 . . . . 64.230000000000004 111.337 178.045 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.569 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 23.2 m120 -130.41 87.41 50.53 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 122.388 -0.195 . . . . 75.420000000000002 110.936 174.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.34 140.4 10.87 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.219 2.612 . . . . 64.219999999999999 114.509 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.8 pt -136.11 149.57 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 120.828 0.347 . . . . 54.130000000000003 110.858 172.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.35 117.36 29.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.579 0.228 . . . . 64.540000000000006 111.097 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 113.527 0.936 . . . . 72.530000000000001 113.527 -173.262 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 113.537 0.94 . . . . 73.209999999999994 113.537 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.03 148.41 41.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.954 -1.021 . . . . 71.439999999999998 111.64 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 65.1 mt -129.01 115.04 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.106 -0.497 . . . . 52.32 110.24 177.073 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 60' ' ' SER . 45.7 mtpt -89.98 136.14 33.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 64.310000000000002 111.813 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.13 153.29 43.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.339 0.59 . . . . 71.430000000000007 112.068 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.6 t70 -63.94 -40.66 96.95 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.309 0.576 . . . . 72.140000000000001 111.028 173.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -165.22 158.49 16.5 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.742 -0.663 . . . . 72.530000000000001 111.112 179.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.445 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 39.2 mt -119.01 123.23 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.136 -0.484 . . . . 53.140000000000001 111.25 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 36.0 m -128.12 -179.8 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 120.781 0.324 . . . . 64.129999999999995 111.75 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.443 HD23 HG12 ' A' ' 76' ' ' VAL . 87.5 mt -91.58 138.16 31.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 73.409999999999997 111.435 177.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.529 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 8.3 m . . . . . 0 N--CA 1.47 0.567 0 CA-C-N 116.046 -0.525 . . . . 53.240000000000002 111.452 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 tpt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 121.049 0.452 . . . . 75.140000000000001 111.641 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -167.81 139.06 2.92 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.913 -0.585 . . . . 74.140000000000001 109.737 174.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -90.65 122.5 33.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.381 0.61 . . . . 74.310000000000002 111.776 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -98.62 133.22 43.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.719 -0.673 . . . . 73.200000000000003 111.014 177.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.26 119.57 7.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.29 -0.414 . . . . 71.019999999999996 111.688 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -85.19 -2.85 58.49 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.933 0.397 . . . . 71.219999999999999 111.807 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.44 -146.59 4.37 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 121.27 -0.491 . . . . 73.25 112.992 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 pt -108.35 146.45 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 121.01 0.433 . . . . 75.209999999999994 111.688 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.6 t -72.52 -54.34 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.149 0.499 . . . . 54.450000000000003 110.807 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.06 168.08 18.0 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.131 -0.486 . . . . 70.219999999999999 110.776 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -106.99 148.5 28.6 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.618 0.246 . . . . 74.439999999999998 110.924 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.503 ' HE2' ' OG1' ' A' ' 14' ' ' THR . 23.4 pttm -125.13 145.07 50.11 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.851 0.358 . . . . 74.019999999999996 111.218 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -89.11 13.94 11.94 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.224 0.453 . . . . 64.409999999999997 112.224 -176.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.503 ' OG1' ' HE2' ' A' ' 12' ' ' LYS . 58.0 p -63.61 -23.23 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.049 0.452 . . . . 72.25 111.529 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -68.47 -5.49 19.65 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.12 -0.491 . . . . 74.439999999999998 111.987 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.4 t80 72.12 -64.95 0.37 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.745 0.783 . . . . 71.349999999999994 110.375 177.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -166.65 -112.18 0.26 Allowed Glycine 0 CA--C 1.519 0.341 0 N-CA-C 109.511 -1.436 . . . . 73.400000000000006 109.511 173.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -103.86 106.51 17.04 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.352 -0.61 . . . . 73.420000000000002 109.352 161.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 93.4 mt -95.48 108.75 21.0 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.598 -0.519 . . . . 72.329999999999998 109.598 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.567 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 59.1 mtmt -124.26 134.8 53.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.255 0.55 . . . . 73.430000000000007 111.689 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.79 144.36 57.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.404 -0.816 . . . . 73.530000000000001 113.012 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 71.7 m -123.55 -62.43 1.31 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.132 -0.485 . . . . 74.329999999999998 111.33 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.16 179.68 8.8 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.161 0.505 . . . . 50.240000000000002 111.916 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.2 tp -101.94 101.32 11.72 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.485 -0.561 . . . . 63.32 109.485 170.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HG2' ' OE1' ' A' ' 58' ' ' GLN . 10.4 tpp180 -58.3 -58.82 6.8 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.225 0.454 . . . . 71.120000000000005 112.225 -173.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -169.14 135.21 1.67 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.84 0.353 . . . . 74.109999999999999 111.73 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -98.82 98.14 9.27 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 110.006 -0.368 . . . . 70.420000000000002 110.006 174.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.49 135.84 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.805 0.336 . . . . 51.310000000000002 110.75 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.464 ' HG2' HD13 ' A' ' 41' ' ' ILE . 80.7 mtt180 -116.68 170.25 8.73 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.476 0.655 . . . . 74.230000000000004 112.742 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -75.1 113.65 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 115.577 -0.738 . . . . 73.140000000000001 111.385 -175.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -83.56 133.83 34.85 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.934 0.397 . . . . 63.399999999999999 111.932 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -80.6 150.25 29.58 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.544 -0.298 . . . . 61.43 110.858 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.22 -34.67 70.66 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.866 0.365 . . . . 65.510000000000005 111.97 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.53 -27.62 66.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.302 -0.408 . . . . 74.109999999999999 111.975 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.26 -57.52 0.64 Allowed Glycine 0 CA--C 1.524 0.64 0 C-N-CA 120.827 -0.701 . . . . 53.009999999999998 113.042 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.1 m -62.96 149.79 43.87 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.428 0.633 . . . . 72.140000000000001 112.375 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 39.5 t -90.94 147.55 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.979 -0.555 . . . . 72.319999999999993 111.228 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -81.31 174.54 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.574 0.702 . . . . 72.25 112.123 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -88.23 -10.4 49.87 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.535 -0.757 . . . . 72.129999999999995 111.225 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 29' ' ' ARG . 21.9 mm-40 -81.89 144.04 31.25 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.125 0.488 . . . . 71.230000000000004 111.871 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.464 HD13 ' HG2' ' A' ' 29' ' ' ARG . 20.7 mm -85.08 153.43 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.945 -0.571 . . . . 53.25 112.323 -172.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -113.9 -58.17 2.18 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 116.343 -0.39 . . . . 72.540000000000006 110.107 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -141.13 160.46 40.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.051 0.54 . . . . 72.450000000000003 110.825 172.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 44' ' ' ARG . 37.7 mtt180 -119.05 117.46 28.82 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.595 0.236 . . . . 75.450000000000003 110.899 178.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.0 m -96.2 121.35 37.89 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 111.91 0.337 . . . . 54.350000000000001 111.91 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.407 ' OH ' HD12 ' A' ' 67' ' ' LEU . 55.8 m-85 -108.47 153.92 22.64 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.235 0.541 . . . . 72.319999999999993 112.021 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -97.0 112.58 24.27 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.757 -0.656 . . . . 74.549999999999997 110.716 174.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.654 HD12 HG21 ' A' ' 59' ' ' VAL . 81.4 mt -123.66 137.42 54.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.691 0.282 . . . . 71.530000000000001 111.19 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.52 140.46 32.73 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.763 0.316 . . . . 72.239999999999995 110.418 174.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.7 p -130.94 149.42 52.57 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.131 0.491 . . . . 73.120000000000005 111.486 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -79.83 121.65 25.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.324 -0.398 . . . . 72.109999999999999 111.43 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.28 -98.3 0.15 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 121.086 -0.578 . . . . 52.399999999999999 113.068 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -92.67 -1.39 56.9 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.048 0.388 . . . . 54.420000000000002 112.048 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 77.37 34.99 38.72 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 121.206 -0.521 . . . . 50.420000000000002 113.567 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -110.88 129.11 55.96 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.296 0.48 . . . . 73.5 112.296 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.4 ptp -72.92 118.69 16.17 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.234 -0.439 . . . . 72.510000000000005 109.983 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.9 pt -94.74 138.08 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-O 120.996 0.426 . . . . 71.409999999999997 111.947 -173.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.495 ' OE1' ' HG2' ' A' ' 25' ' ' ARG . 25.2 mm-40 -93.16 104.71 16.88 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.24 -0.436 . . . . 75.549999999999997 110.977 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.654 HG21 HD12 ' A' ' 48' ' ' LEU . 81.0 t -98.49 116.16 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-O 120.875 0.369 . . . . 73.230000000000004 111.481 -177.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.9 t -111.06 123.93 51.16 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.872 0.368 . . . . 43.109999999999999 111.697 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.401 HD12 ' CG1' ' A' ' 65' ' ' VAL . 32.0 pt -115.31 147.06 37.79 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.328 -0.396 . . . . 70.049999999999997 110.944 176.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.95 157.61 51.83 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 122.325 2.017 . . . . 70.049999999999997 113.698 -177.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.01 -33.27 66.99 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.879 0.696 . . . . 61.240000000000002 112.879 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 58.4 m -58.32 -19.42 34.83 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.737 0.303 . . . . 45.229999999999997 111.721 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG1' HD12 ' A' ' 61' ' ' ILE . 43.9 t -91.31 126.07 56.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-N 116.545 -0.298 . . . . 73.209999999999994 110.829 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.78 162.1 43.38 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.406 2.07 . . . . 71.420000000000002 113.149 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.407 HD12 ' OH ' ' A' ' 46' ' ' TYR . 52.6 tp -72.42 142.33 48.67 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.202 -0.454 . . . . 75.530000000000001 111.183 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.02 106.72 15.89 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.259 0.552 . . . . 74.329999999999998 111.475 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -74.79 74.87 2.1 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.72 -0.673 . . . . 74.109999999999999 111.568 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -94.67 154.43 17.33 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.967 0.413 . . . . 65.540000000000006 112.009 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.3 170.47 16.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.005 0.431 . . . . 63.450000000000003 111.671 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -67.75 129.95 41.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.043 0.449 . . . . 62.340000000000003 111.687 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.567 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 90.3 m-20 69.42 18.31 7.91 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.604 0.762 . . . . 64.109999999999999 113.028 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.38 132.66 52.2 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.193 -0.317 . . . . 73.120000000000005 110.958 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.1 mtm180 -76.36 118.67 19.3 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.025 0.44 . . . . 65.319999999999993 111.932 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.563 HG12 HD23 ' A' ' 107' ' ' LEU . 34.0 m -124.75 161.38 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.999 -0.546 . . . . 71.519999999999996 111.489 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -138.49 147.23 42.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.125 0.488 . . . . 72.209999999999994 110.311 171.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.9 mt -97.81 137.49 36.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.308 -0.405 . . . . 60.039999999999999 112.035 -173.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.5 mm -63.57 -71.16 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 CA-C-N 116.12 -0.491 . . . . 75.209999999999994 111.413 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.477 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 92.4 m-20 -122.75 82.96 48.95 Favored Pre-proline 0 N--CA 1.473 0.694 0 CA-C-O 120.667 0.27 . . . . 64.230000000000004 111.438 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -82.43 132.2 6.81 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.977 2.451 . . . . 73.439999999999998 113.574 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.5 pt -136.91 125.71 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 120.858 0.361 . . . . 73.129999999999995 111.492 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.02 114.11 18.68 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.302 -0.259 . . . . 41.210000000000001 110.302 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -90.79 173.09 8.19 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.604 0.716 . . . . 60.100000000000001 112.495 -170.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.447 ' O ' HG22 ' A' ' 85' ' ' THR . 20.2 m -129.99 13.41 5.74 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.528 -0.76 . . . . 64.030000000000001 109.946 171.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -83.37 -32.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 116.283 -0.417 . . . . 74.140000000000001 111.534 -177.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.56 -56.87 9.96 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.04 0.448 . . . . 71.510000000000005 110.73 175.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p -65.53 -7.2 13.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.011 -0.54 . . . . 74.109999999999999 112.194 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -85.16 -24.46 27.94 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.825 0.306 . . . . 62.310000000000002 111.825 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.8 t -108.98 -21.62 12.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.891 0.33 . . . . 75.099999999999994 111.891 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -101.71 158.47 16.08 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.884 0.374 . . . . 61.409999999999997 111.072 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -154.44 120.79 5.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.033 0.444 . . . . 75.439999999999998 111.175 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 94.49 -30.52 7.7 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 121.134 -0.555 . . . . 50.030000000000001 112.923 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.69 -22.51 34.52 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.91 0.386 . . . . 73.329999999999998 111.651 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.7 82.19 1.57 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.46 . . . . 71.319999999999993 111.543 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -84.99 -28.47 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.326 -0.397 . . . . 74.099999999999994 111.557 177.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -126.3 167.26 15.73 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.69 0.281 . . . . 61.439999999999998 110.689 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -95.22 150.84 19.79 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.253 0.549 . . . . 63.520000000000003 112.329 -174.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -107.48 137.85 44.77 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.622 0.725 . . . . 65.030000000000001 112.318 -171.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 52.7 mt -126.68 109.16 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.567 -0.742 . . . . 71.540000000000006 110.716 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -82.73 129.2 34.93 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 122.138 -0.351 . . . . 73.540000000000006 110.493 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.9 167.39 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.289 0.566 . . . . 61.520000000000003 112.355 -174.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.477 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 31.3 t70 -86.68 -62.04 1.6 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.763 -0.653 . . . . 64.420000000000002 111.235 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -145.59 155.03 42.79 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.127 0.489 . . . . 71.019999999999996 111.122 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 71.0 mt -111.81 115.07 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 115.734 -0.666 . . . . 60.420000000000002 111.577 -178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.32 172.23 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 120.549 0.214 . . . . 65.25 111.055 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.563 HD23 HG12 ' A' ' 76' ' ' VAL . 96.2 mt -83.15 150.0 26.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 122.284 -0.26 . . . . 74.319999999999993 110.892 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.1 m -62.63 105.86 0.7 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.762 0.315 . . . . 75.400000000000006 111.345 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.496 HD23 ' H ' ' A' ' 109' ' ' LEU . 0.5 OUTLIER -86.3 -11.93 50.85 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.533 0.568 . . . . 73.439999999999998 112.533 -174.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.403 ' OE1' ' HG2' ' A' ' 12' ' ' LYS . 51.2 mt-10 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.743 -0.646 . . . . 70.230000000000004 112.048 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 120.845 0.355 . . . . 72.209999999999994 111.57 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 64.9 mtt -132.91 153.01 51.79 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.581 0.353 . . . . 75.519999999999996 110.764 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.462 ' HD2' ' N ' ' A' ' 3' ' ' ARG . 7.8 mpt_? -96.84 125.11 41.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.855 0.359 . . . . 72.430000000000007 111.184 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.429 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.1 mm? -95.1 139.39 31.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.064 0.459 . . . . 75.450000000000003 110.911 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.27 165.69 19.16 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.272 0.558 . . . . 72.239999999999995 112.148 -177.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -72.66 153.33 41.26 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.843 -0.617 . . . . 73.120000000000005 111.452 -178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.73 89.88 0.12 Allowed Glycine 0 CA--C 1.526 0.771 0 C-N-CA 121.3 -0.476 . . . . 51.420000000000002 112.718 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 34.1 pt -91.65 176.16 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 112.59 0.589 . . . . 60.25 112.59 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 45.2 t -80.84 143.26 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 61.109999999999999 111.497 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 pp -140.29 170.1 16.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.422 -0.354 . . . . 61.509999999999998 111.374 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.35 107.23 0.87 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 61.109999999999999 111.852 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -115.7 122.75 46.46 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.282 -0.417 . . . . 61.119999999999997 111.008 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.9 t70 62.59 83.93 0.15 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.356 0.598 . . . . 71.310000000000002 110.867 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.8 p -94.41 -83.69 0.34 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.639 0.607 . . . . 73.099999999999994 112.639 -175.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 15' ' ' THR . 6.4 m -86.7 16.85 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.073 0.463 . . . . 71.540000000000006 111.524 -177.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 63.11 -179.5 0.15 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.381 0.61 . . . . 53.329999999999998 112.218 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -98.32 -145.14 18.27 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.207 -0.521 . . . . 43.409999999999997 112.059 174.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.58 124.88 37.87 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.732 0.777 . . . . 71.310000000000002 110.855 175.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 57' ' ' ILE . 55.4 mt -89.15 159.22 17.6 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.466 -0.788 . . . . 64.5 111.965 -171.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.578 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 11.1 mptt -116.62 115.67 26.14 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.855 0.36 . . . . 71.299999999999997 111.506 178.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.402 ' HA ' HD23 ' A' ' 48' ' ' LEU . 91.1 t80 -66.8 126.77 30.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.231 -0.44 . . . . 72.439999999999998 111.154 177.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.559 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 82.0 p -106.83 -63.51 1.27 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.949 0.351 . . . . 72.400000000000006 111.949 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.92 176.61 12.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.345 0.593 . . . . 52.100000000000001 112.087 -177.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.44 HD21 ' HG3' ' A' ' 27' ' ' GLU . 61.1 tp -83.16 117.81 23.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.985 -0.552 . . . . 65.310000000000002 111.101 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -69.07 -66.81 0.53 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.939 0.399 . . . . 75.439999999999998 111.363 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -168.25 131.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.061 0.458 . . . . 73.120000000000005 111.745 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' HG3' HD21 ' A' ' 24' ' ' LEU . 47.2 mt-10 -96.8 99.37 10.95 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.315 -0.402 . . . . 64.530000000000001 110.058 173.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m -74.34 118.98 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.281 0.562 . . . . 73.25 111.516 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.638 ' HG2' HG12 ' A' ' 41' ' ' ILE . 96.3 mtt180 -96.54 164.36 12.64 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.443 0.64 . . . . 71.5 112.291 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.88 111.19 13.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 115.793 -0.64 . . . . 71.530000000000001 111.041 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.5 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 61.6 tt0 -82.75 147.11 28.62 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.053 0.454 . . . . 75.129999999999995 111.617 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -90.93 166.94 12.78 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.924 0.392 . . . . 64.230000000000004 110.477 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.39 -24.73 57.25 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 122.131 -0.356 . . . . 74.530000000000001 111.678 -178.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -80.91 32.27 0.32 Allowed 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 111.965 0.357 . . . . 71.239999999999995 111.965 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.45 -48.08 3.75 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 114.182 0.433 . . . . 71.209999999999994 114.182 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 m -66.79 145.3 55.65 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.236 0.541 . . . . 72.150000000000006 112.428 -177.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.5 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.5 t -96.29 140.65 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.018 -0.537 . . . . 75.319999999999993 111.161 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -75.65 171.68 13.9 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.313 0.578 . . . . 71.340000000000003 111.293 178.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.3 -18.3 32.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 53.140000000000001 110.707 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.38 137.62 57.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.624 -0.716 . . . . 55.119999999999997 110.603 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.638 HG12 ' HG2' ' A' ' 29' ' ' ARG . 32.4 mt -104.46 142.57 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 121.179 0.514 . . . . 75.439999999999998 111.377 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.55 -57.78 2.38 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.274 -0.421 . . . . 72.329999999999998 111.043 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' OG ' ' A' ' 60' ' ' SER . 61.7 mt-10 -137.46 148.48 46.13 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 120.992 0.425 . . . . 73.219999999999999 111.688 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -110.2 111.58 23.0 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.357 -0.383 . . . . 73.140000000000001 111.166 176.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.4 m -101.46 124.16 46.69 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.393 0.516 . . . . 72.150000000000006 112.393 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.447 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.2 m-85 -115.83 160.58 19.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.905 0.482 . . . . 72.310000000000002 111.045 177.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -101.12 125.61 47.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.714 0.292 . . . . 43.399999999999999 111.67 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.57 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -123.52 134.37 53.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-O 120.795 0.331 . . . . 71.109999999999999 111.722 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HE2' ' HB3' ' A' ' 22' ' ' SER . 3.8 mptp? -80.77 147.25 30.59 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.98 0.419 . . . . 74.230000000000004 111.313 173.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -83.1 166.79 18.42 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.083 -0.508 . . . . 72.420000000000002 110.507 174.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.72 0.55 6.81 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.369 0.507 . . . . 74.549999999999997 112.369 178.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 142.5 27.48 0.16 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 121.013 -0.613 . . . . 61.030000000000001 113.917 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -91.35 -0.75 57.7 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.048 0.424 . . . . 70.019999999999996 111.832 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.2 35.85 90.99 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.35 -0.452 . . . . 72.140000000000001 113.563 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 55' ' ' ARG . 5.3 ptp180 -140.82 137.07 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.975 0.417 . . . . 72.510000000000005 111.933 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 43.1 ttm -96.88 110.43 22.94 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.133 -0.485 . . . . 74.109999999999999 109.701 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.432 HD11 HD13 ' A' ' 19' ' ' LEU . 26.8 pt -95.1 127.97 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 121.026 0.441 . . . . 73.140000000000001 111.176 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.448 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 77.3 mt-30 -93.65 105.82 17.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.378 0.608 . . . . 71.030000000000001 110.656 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.57 HG21 HD12 ' A' ' 48' ' ' LEU . 84.0 t -94.82 122.53 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 115.988 -0.551 . . . . 74.549999999999997 111.986 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.729 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 24.5 t -114.35 130.21 56.67 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.968 0.413 . . . . 75.340000000000003 111.377 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 pt -120.36 156.2 55.54 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 116.315 -0.402 . . . . 71.549999999999997 110.982 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.35 125.75 19.44 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.452 2.101 . . . . 61.310000000000002 112.392 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.5 39.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.016 0.747 . . . . 73.409999999999997 113.016 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.0 t -56.82 -30.76 64.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.058 0.456 . . . . 54.130000000000003 111.519 175.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.4 t -78.75 133.88 61.75 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 116.069 -0.514 . . . . 72.239999999999995 111.328 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.49 158.01 4.41 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.379 2.719 . . . . 75.519999999999996 114.476 -178.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.447 HD12 ' OH ' ' A' ' 46' ' ' TYR . 58.6 tp -68.14 145.81 54.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.254 -0.885 . . . . 61.549999999999997 111.767 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -90.12 126.03 35.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.254 0.549 . . . . 63.420000000000002 111.88 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -107.65 25.78 11.09 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.661 -0.7 . . . . 73.219999999999999 111.592 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -62.19 153.45 30.3 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.208 0.528 . . . . 75.209999999999994 112.087 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -80.97 164.71 22.35 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.894 -0.594 . . . . 33.119999999999997 112.267 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -59.12 118.08 5.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.065 -0.516 . . . . 71.450000000000003 111.614 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 68.31 24.25 7.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.55 0.74 . . . . 73.420000000000002 112.216 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.79 133.92 50.06 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.765 0.317 . . . . 73.530000000000001 111.3 176.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.578 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 75.5 mtm180 -74.63 113.49 11.95 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.116 0.484 . . . . 73.329999999999998 111.682 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.16 153.99 35.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.284 0.564 . . . . 73.310000000000002 111.999 -177.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.4 pt-20 -128.01 154.72 45.31 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.126 -0.488 . . . . 72.129999999999995 110.268 173.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.35 146.67 24.54 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.168 0.803 . . . . 71.409999999999997 113.168 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.72 112.49 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 115.336 -0.847 . . . . 62.399999999999999 110.036 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 58.78 62.01 4.59 Favored Pre-proline 0 CA--C 1.547 0.864 0 N-CA-C 112.023 0.379 . . . . 62.140000000000001 112.023 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -81.66 140.45 11.75 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.817 2.345 . . . . 75.099999999999994 113.8 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.44 147.23 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-O 120.945 0.402 . . . . 55.549999999999997 111.099 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.35 108.16 16.35 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.916 0.389 . . . . 72.030000000000001 110.693 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -80.76 98.11 7.62 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.214 0.53 . . . . 61.25 111.564 -174.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.8 p -73.46 -28.09 61.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.017 -0.538 . . . . 75.510000000000005 112.146 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.5 m -73.86 -15.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 112.265 0.469 . . . . 63.229999999999997 112.265 -177.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.45 -59.34 4.7 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.739 0.274 . . . . 61.009999999999998 111.739 176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 t -62.57 -28.06 69.61 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 120.98 0.419 . . . . 65.530000000000001 111.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.27 60.31 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.845 0.355 . . . . 73.140000000000001 111.519 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 52.4 m -96.25 -41.09 8.84 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.847 0.356 . . . . 54.229999999999997 111.927 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -118.18 93.82 4.27 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.635 -0.257 . . . . 53.420000000000002 111.59 -176.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -77.46 143.49 38.5 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.003 0.43 . . . . 75.299999999999997 110.991 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 105.62 7.75 36.18 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 121.122 -0.561 . . . . 63.210000000000001 112.648 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -150.79 32.79 0.61 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.689 0.757 . . . . 51.200000000000003 109.566 176.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -75.68 -45.68 35.59 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.797 -1.092 . . . . 73.219999999999999 112.998 -168.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.08 -32.56 48.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 N-CA-C 112.798 0.666 . . . . 63.340000000000003 112.798 -172.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -88.4 80.97 7.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.544 0.688 . . . . 75.140000000000001 110.322 175.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 148.33 16.51 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 114.352 1.241 . . . . 74.129999999999995 114.352 -174.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.448 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -104.39 120.75 41.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.406 -1.27 . . . . 75.129999999999995 111.818 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.489 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 56.4 mt -99.59 107.18 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 109.968 175.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.729 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 58.7 mtpt -94.06 129.14 40.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.15 0.5 . . . . 73.329999999999998 111.942 -175.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.48 174.7 7.62 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.991 0.425 . . . . 71.420000000000002 111.467 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.23 -37.05 26.56 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.952 0.406 . . . . 71.200000000000003 110.787 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -161.01 164.93 30.6 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 116.316 -0.402 . . . . 73.319999999999993 111.502 177.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 44.2 mt -122.56 118.39 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 116.494 -0.321 . . . . 73.349999999999994 110.815 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.38 167.13 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 120.793 0.33 . . . . 74.109999999999999 111.652 -177.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -70.74 144.13 51.03 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.649 0.262 . . . . 71.230000000000004 111.123 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.414 ' HA ' ' HG2' ' A' ' 77' ' ' GLU . 57.8 m -63.54 121.6 14.26 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.837 0.351 . . . . 64.010000000000005 111.881 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.01 94.26 0.23 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.164 -0.471 . . . . 74.540000000000006 111.635 178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 118.942 -0.551 . . . . 74.400000000000006 111.18 177.367 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.571 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 111.787 0.292 . . . . 61.399999999999999 111.787 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.5 ' HG2' ' HG2' ' A' ' 1' ' ' MET . 25.2 ptt? -176.54 133.49 0.22 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.812 0.339 . . . . 63.350000000000001 110.855 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.0 mtp180 -103.9 139.49 38.99 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.902 0.382 . . . . 63.200000000000003 111.57 -177.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.439 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.0 mm? -101.3 176.79 5.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.851 0.357 . . . . 64.099999999999994 110.795 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.27 -21.55 62.95 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.999 0.428 . . . . 75.230000000000004 111.965 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -69.83 112.67 6.43 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.451 -0.341 . . . . 71.129999999999995 111.903 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.74 -76.77 0.79 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 121.365 -0.445 . . . . 33.229999999999997 112.57 175.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.6 pt -105.97 158.53 6.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 72.239999999999995 111.742 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.5 t -130.76 118.78 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.366 -0.379 . . . . 65.329999999999998 110.565 177.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -65.15 166.9 8.88 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.065 0.459 . . . . 63.539999999999999 111.713 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -100.78 -60.27 1.55 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.465 -0.334 . . . . 71.420000000000002 111.732 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -174.45 102.41 0.1 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.951 0.405 . . . . 74.209999999999994 110.692 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -74.4 -18.13 60.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.563 0.579 . . . . 74.439999999999998 112.563 -176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.1 p -71.14 95.36 1.23 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.334 0.588 . . . . 75.310000000000002 111.367 179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.0 p -59.84 -14.08 13.47 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.752 0.649 . . . . 71.540000000000006 112.752 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -85.9 -0.29 55.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.657 0.265 . . . . 74.349999999999994 111.523 177.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.42 -143.92 29.97 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 121.215 -0.517 . . . . 54.439999999999998 111.81 -172.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.459 ' H ' ' HB3' ' A' ' 51' ' ' LYS . 1.7 mp0 -87.76 131.22 34.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 117.306 0.553 . . . . 62.329999999999998 110.57 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -85.33 127.45 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.813 0.34 . . . . 75.310000000000002 110.174 175.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 56.9 mtmt -123.71 117.22 24.45 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.258 0.551 . . . . 72.299999999999997 111.978 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.7 157.46 9.35 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.948 -1.024 . . . . 73.109999999999999 113.03 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.48 ' OG ' ' HE3' ' A' ' 49' ' ' LYS . 33.9 m -134.14 -65.22 0.66 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.208 0.448 . . . . 63.219999999999999 112.208 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.52 -179.29 7.53 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.222 0.534 . . . . 42.109999999999999 112.307 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.437 HD21 ' HG3' ' A' ' 27' ' ' GLU . 59.0 tp -88.29 120.08 29.32 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.833 -0.621 . . . . 40.5 110.308 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -76.37 -55.31 5.66 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.982 0.42 . . . . 74.420000000000002 111.421 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -173.57 131.74 0.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.141 -0.482 . . . . 75.420000000000002 111.003 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG3' HD21 ' A' ' 24' ' ' LEU . 37.7 mt-10 -90.83 98.63 11.89 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.721 -0.474 . . . . 60.420000000000002 109.721 171.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.4 m -67.27 119.22 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.33 0.586 . . . . 74.439999999999998 111.284 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.519 ' HG2' HG12 ' A' ' 41' ' ' ILE . 56.5 mtt180 -98.48 167.91 10.52 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.378 0.609 . . . . 63.409999999999997 112.081 -175.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -83.07 100.22 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.842 -0.617 . . . . 74.239999999999995 112.041 -172.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 60.9 tt0 -79.41 120.74 24.26 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.482 -0.326 . . . . 75.340000000000003 110.961 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -67.46 153.34 43.91 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.379 0.511 . . . . 75.209999999999994 112.379 -174.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.02 -32.37 67.89 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.565 0.697 . . . . 61.140000000000001 110.702 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.24 -27.77 66.08 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.225 -0.898 . . . . 62.109999999999999 112.002 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.55 -42.15 1.52 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 121.383 -0.437 . . . . 73.439999999999998 112.737 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -75.85 151.62 37.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.063 0.459 . . . . 74.140000000000001 111.702 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 36.9 t -88.13 136.86 22.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.411 -0.359 . . . . 72.109999999999999 111.414 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t -84.83 149.89 25.4 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.765 0.317 . . . . 63.43 110.539 174.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.05 -14.79 61.48 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.131 0.419 . . . . 33.530000000000001 112.131 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.28 142.2 58.5 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.936 0.398 . . . . 64.140000000000001 111.333 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.519 HG12 ' HG2' ' A' ' 29' ' ' ARG . 43.9 mt -100.58 139.07 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.501 -0.318 . . . . 75.109999999999999 110.696 -178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.61 -58.29 2.23 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.776 0.322 . . . . 74.129999999999995 111.121 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.42 159.38 42.29 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.135 0.493 . . . . 73.109999999999999 111.505 177.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 37.2 mtt-85 -115.62 116.89 28.89 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.264 -0.425 . . . . 62.520000000000003 110.67 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 m -92.49 129.09 38.52 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.655 0.243 . . . . 44.329999999999998 111.655 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' OH ' HD12 ' A' ' 67' ' ' LEU . 49.6 m-85 -116.77 156.52 27.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.679 0.392 . . . . 72.420000000000002 111.442 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -100.18 112.78 25.1 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.166 -0.47 . . . . 75.329999999999998 111.061 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 59' ' ' VAL . 42.2 mt -114.93 149.01 37.93 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 122.292 -0.255 . . . . 74.540000000000006 110.788 177.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.543 ' HB2' ' NZ ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -103.83 141.55 35.93 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 122.043 -0.411 . . . . 73.420000000000002 111.469 173.191 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.9 p -93.46 115.96 28.49 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.073 -0.512 . . . . 72.230000000000004 110.743 176.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.459 ' HB3' ' H ' ' A' ' 18' ' ' GLU . 1.2 tmtp? -57.92 -40.66 80.94 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.921 0.391 . . . . 63.43 111.507 178.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.36 -58.53 9.28 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.268 -0.492 . . . . 62.32 113.969 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -85.77 -31.45 22.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.325 0.491 . . . . 64.530000000000001 112.325 -176.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 92.79 24.95 21.84 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 120.877 -0.678 . . . . 65.409999999999997 114.525 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -139.88 167.22 22.61 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 117.601 0.701 . . . . 73.439999999999998 112.282 177.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.566 ' N ' ' SD ' ' A' ' 56' ' ' MET . 1.2 mpt? -79.13 157.94 27.84 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.319 0.859 . . . . 73.329999999999998 113.319 -173.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.1 pt -142.03 135.02 28.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.01 -0.995 . . . . 64.140000000000001 109.586 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.446 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 24.0 mp0 -93.15 104.35 16.55 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.159 0.504 . . . . 72.540000000000006 111.574 -178.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -96.94 130.02 46.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 116.378 -0.373 . . . . 54.100000000000001 111.419 -177.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m -119.15 129.26 54.92 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.682 0.277 . . . . 71.109999999999999 111.434 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.403 HG12 ' HE1' ' A' ' 46' ' ' TYR . 25.9 pt -123.23 149.6 57.99 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.584 -0.28 . . . . 63.409999999999997 110.575 176.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.73 139.62 39.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.557 2.171 . . . . 71.25 113.226 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.2 -26.32 67.64 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 112.585 0.587 . . . . 73.019999999999996 112.585 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.4 t -63.8 -30.28 71.39 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.03 0.443 . . . . 64.400000000000006 111.3 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.0 t -72.18 130.41 86.38 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.216 -0.447 . . . . 72.239999999999995 110.708 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -43.66 131.88 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 123.175 2.584 . . . . 74.150000000000006 114.323 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.468 HD12 ' OH ' ' A' ' 46' ' ' TYR . 62.0 tp -58.37 137.68 57.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.996 -0.547 . . . . 72.310000000000002 111.201 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -75.05 125.95 30.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.198 0.523 . . . . 73.329999999999998 111.255 177.093 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -118.01 22.43 12.24 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.849 -0.614 . . . . 61.43 111.384 -175.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.419 ' CE2' ' HG3' ' A' ' 68' ' ' LYS . 26.0 m-85 -69.34 172.29 7.31 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.522 0.564 . . . . 64.409999999999997 112.522 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.43 174.93 8.66 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.879 -0.6 . . . . 72.319999999999993 111.576 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -74.21 135.66 42.76 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 110.012 -0.366 . . . . 61.219999999999999 110.012 176.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 95.0 m-20 60.56 20.97 10.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.799 0.44 . . . . 74.549999999999997 112.105 -174.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . -68.13 139.9 56.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.926 0.393 . . . . 70.099999999999994 111.663 178.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.601 HH11 ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -68.1 111.13 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.073 -0.512 . . . . 74.209999999999994 111.145 179.342 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.9 m -129.41 147.92 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.362 0.601 . . . . 74.25 112.133 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -133.16 151.2 51.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.025 -0.534 . . . . 72.299999999999997 110.727 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -99.95 135.48 41.32 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.301 -0.409 . . . . 63.140000000000001 111.768 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.442 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.8 mp -67.77 -76.01 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.386 -0.37 . . . . 63.439999999999998 111.061 177.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -126.7 85.36 60.8 Favored Pre-proline 0 N--CA 1.472 0.648 0 CA-C-O 120.754 0.312 . . . . 73.450000000000003 110.951 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.27 156.19 14.63 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 123.219 2.613 . . . . 50.329999999999998 114.469 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.4 pt -142.81 123.11 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.82 -0.627 . . . . 75.540000000000006 110.32 171.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.0 126.88 30.87 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.354 -0.216 . . . . 64.150000000000006 110.929 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -65.64 147.54 53.23 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.193 0.52 . . . . 62.420000000000002 111.271 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.2 m -64.26 -55.89 18.33 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.978 -0.555 . . . . 71.329999999999998 112.287 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.7 m -146.53 91.38 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 120.941 0.401 . . . . 63.350000000000001 111.646 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.15 -23.72 65.75 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.269 0.47 . . . . 44.549999999999997 112.269 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.4 t -81.03 -9.07 59.89 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.009 0.433 . . . . 74.540000000000006 112.037 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -121.12 -45.0 2.37 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.202 0.445 . . . . 74.019999999999996 112.202 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.7 p -57.57 -54.08 50.9 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.236 0.541 . . . . 62.43 110.5 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -88.05 96.33 10.47 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.974 -0.751 . . . . 74.0 108.974 167.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -61.82 91.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.488 0.661 . . . . 74.239999999999995 112.495 -171.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -175.74 138.06 4.02 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.38 -0.827 . . . . 75.430000000000007 111.512 177.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.21 87.33 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.294 0.547 . . . . 41.009999999999998 112.424 -176.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -132.15 173.4 11.27 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.415 -0.357 . . . . 72.430000000000007 110.158 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' VAL . 8.3 p -135.66 0.17 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 N-CA-C 112.983 0.735 . . . . 62.149999999999999 112.983 -174.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.98 -171.05 2.72 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.641 -0.662 . . . . 63.340000000000003 110.151 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 -146.23 144.72 30.07 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.984 0.897 . . . . 65.209999999999994 113.309 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 37.6 m-85 -106.57 149.49 27.11 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.861 -1.063 . . . . 74.109999999999999 111.683 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.3 mt -130.37 108.02 15.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 116.227 -0.442 . . . . 74.129999999999995 110.311 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -77.99 129.25 35.06 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 122.295 -0.253 . . . . 72.140000000000001 111.139 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -130.65 151.71 50.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.29 0.478 . . . . 73.0 112.29 -176.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.1 -39.88 93.98 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.18 -0.464 . . . . 63.140000000000001 111.436 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -172.39 162.3 5.38 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.207 -0.451 . . . . 73.219999999999999 111.092 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.412 HG12 ' CD2' ' A' ' 78' ' ' LEU . 31.2 mt -122.42 117.43 52.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 115.938 -0.573 . . . . 72.530000000000001 110.839 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.9 m -122.34 -179.33 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.21 0.204 . . . . 74.200000000000003 111.232 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 88.4 mt -77.85 147.55 35.09 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 120.952 0.406 . . . . 74.299999999999997 111.943 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.8 m -72.55 143.12 48.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.358 0.503 . . . . 32.329999999999998 112.358 -177.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.45 46.24 1.36 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.792 0.664 . . . . 73.340000000000003 112.792 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.253 1.27 0 CA-C-O 118.746 -0.645 . . . . 75.299999999999997 111.58 177.638 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 111.71 0.263 . . . . 62.32 111.71 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.25 88.01 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.308 0.484 . . . . 62.409999999999997 112.308 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.3 ptt180 54.11 -3.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.558 1.318 . . . . 73.209999999999994 114.558 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.3 mt -64.38 -53.18 52.55 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.795 -0.566 . . . . 73.219999999999999 111.365 -178.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.656 ' HB1' ' O ' ' A' ' 8' ' ' ILE . . . -115.6 -65.28 1.21 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.972 -0.558 . . . . 74.040000000000006 111.145 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 59.4 t30 64.13 -78.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.924 0.713 . . . . 75.340000000000003 112.924 174.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 -47.21 27.58 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 121.262 -0.494 . . . . 73.530000000000001 113.382 -176.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.656 ' O ' ' HB1' ' A' ' 5' ' ' ALA . 34.3 pt -129.61 -170.64 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 122.399 0.279 . . . . 70.230000000000004 110.398 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -148.48 131.63 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 120.835 0.35 . . . . 65.030000000000001 110.91 175.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.45 HD23 ' N ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -125.67 -9.34 6.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.823 0.344 . . . . 75.209999999999994 111.713 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.09 -19.41 34.33 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 120.75 0.309 . . . . 73.439999999999998 111.816 175.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -125.95 125.22 42.37 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.919 0.34 . . . . 55.229999999999997 111.919 -176.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -72.93 104.4 4.06 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.913 0.387 . . . . 53.109999999999999 111.531 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.0 t -77.35 145.1 37.53 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.765 0.317 . . . . 72.140000000000001 111.204 176.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.2 p -114.67 136.74 52.72 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.997 0.427 . . . . 55.210000000000001 111.931 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -87.63 154.44 20.6 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.22 -0.445 . . . . 64.150000000000006 111.622 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -86.78 169.88 41.23 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.731 -0.747 . . . . 62.299999999999997 112.533 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -54.53 109.19 0.46 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.546 0.688 . . . . 73.439999999999998 111.495 178.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt -74.68 147.69 41.24 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.855 -0.612 . . . . 75.310000000000002 112.263 -173.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.569 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 47.4 mmtm -123.97 121.86 36.4 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 55.310000000000002 111.456 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -66.75 102.04 0.89 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.818 0.342 . . . . 74.200000000000003 110.581 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 21.9 t -89.61 -63.59 1.26 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 111.972 0.36 . . . . 60.210000000000001 111.972 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.29 -178.52 7.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.288 0.477 . . . . 62.109999999999999 112.288 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.6 tp -89.35 118.03 28.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.941 0.4 . . . . 62.149999999999999 110.896 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.8 -64.48 1.03 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.958 0.409 . . . . 75.409999999999997 111.748 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -164.71 136.85 4.52 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.36 -0.382 . . . . 75.219999999999999 111.335 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -97.9 101.46 12.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.803 0.335 . . . . 74.430000000000007 110.243 173.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' HB2' ' A' ' 42' ' ' LYS . 18.3 m -72.2 98.75 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 121.657 0.741 . . . . 64.140000000000001 111.327 -178.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 41' ' ' ILE . 85.6 mtt-85 -89.64 155.66 19.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.881 -0.6 . . . . 70.310000000000002 111.611 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.595 HG12 ' HE3' ' A' ' 42' ' ' LYS . 56.7 mt -68.85 106.66 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.995 -0.548 . . . . 71.340000000000003 111.258 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -85.61 123.93 31.58 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.839 0.352 . . . . 73.109999999999999 110.925 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -66.35 157.19 32.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.31 -0.405 . . . . 74.219999999999999 111.714 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -62.46 -25.84 68.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.077 0.465 . . . . 75.400000000000006 110.99 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -63.87 -15.84 59.92 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 116.021 -0.536 . . . . 74.400000000000006 111.611 175.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 -18.46 40.91 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.399 -0.364 . . . . 44.210000000000001 112.866 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.4 p -77.8 157.49 29.93 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.14 0.495 . . . . 70.430000000000007 111.876 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.0 t -102.4 134.85 42.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.459 -0.337 . . . . 73.540000000000006 111.28 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.4 t -90.77 155.3 18.89 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.833 0.349 . . . . 62.119999999999997 111.701 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.36 -30.51 69.6 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.161 0.505 . . . . 75.239999999999995 110.686 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.23 138.91 57.42 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.49 -0.777 . . . . 72.200000000000003 111.799 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.631 HG12 ' HG2' ' A' ' 29' ' ' ARG . 53.1 mt -115.9 138.17 47.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.943 0.401 . . . . 73.409999999999997 111.983 -175.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' HE3' HG12 ' A' ' 30' ' ' ILE . 32.8 mmtp -72.67 -57.18 4.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.444 0.64 . . . . 73.439999999999998 110.205 171.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HB3' ' HA ' ' A' ' 62' ' ' PRO . 8.9 pt-20 -163.92 166.15 21.99 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.489 -0.778 . . . . 60.240000000000002 111.563 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.531 HH12 ' HB2' ' A' ' 67' ' ' LEU . 31.2 mtp180 -114.3 118.34 33.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.464 -0.334 . . . . 74.439999999999998 111.5 -172.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 21.8 m -92.87 131.04 38.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 111.827 0.306 . . . . 71.120000000000005 111.827 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -120.48 143.78 48.35 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.01 0.433 . . . . 71.099999999999994 111.88 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -75.12 109.31 8.5 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.927 -0.579 . . . . 61.240000000000002 110.496 173.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.467 HD12 HG21 ' A' ' 59' ' ' VAL . 41.0 mt -111.93 131.99 55.03 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.354 0.597 . . . . 51.329999999999998 111.808 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.6 mmtm -96.07 136.42 36.54 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.947 -0.569 . . . . 55.240000000000002 110.41 176.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.5 t -126.41 105.14 8.56 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 122.055 -0.403 . . . . 72.329999999999998 111.425 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -65.19 -40.06 93.69 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.865 0.364 . . . . 60.299999999999997 111.807 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.64 -23.06 48.55 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 121.219 -0.515 . . . . 71.400000000000006 114.205 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -112.54 -23.07 10.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 117.426 0.613 . . . . 64.519999999999996 111.934 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 87.94 -5.09 85.36 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.352 0.501 . . . . 72.25 114.352 175.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -118.44 172.55 7.39 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.572 0.701 . . . . 75.400000000000006 112.808 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 70.5 mtp -93.14 137.43 32.49 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.245 -0.889 . . . . 72.239999999999995 110.725 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.409 HG22 ' NE1' ' A' ' 98' ' ' TRP . 40.0 pt -121.64 138.71 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 120.956 0.407 . . . . 70.400000000000006 111.114 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.7 106.41 18.72 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.519 -0.309 . . . . 72.230000000000004 111.395 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 95.7 t -105.24 128.76 58.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.441 0.534 . . . . 74.239999999999995 112.441 -176.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -113.67 132.5 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.177 -0.465 . . . . 64.400000000000006 111.645 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -110.92 136.38 20.77 Favored Pre-proline 0 N--CA 1.474 0.764 0 CA-C-O 120.522 0.201 . . . . 65.040000000000006 111.073 175.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 33.3 Cg_endo -62.28 158.44 40.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.752 2.301 . . . . 72.120000000000005 113.33 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.99 -16.65 5.15 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.823 0.675 . . . . 72.340000000000003 112.823 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -68.86 -10.23 55.84 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.159 0.429 . . . . 45.210000000000001 112.159 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 44.8 t -108.82 129.75 23.57 Favored Pre-proline 0 CA--C 1.544 0.716 0 N-CA-C 112.261 0.467 . . . . 63.240000000000002 112.261 -176.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 28.9 Cg_exo -64.74 161.68 34.9 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.742 2.295 . . . . 70.25 113.072 174.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.531 ' HB2' HH12 ' A' ' 44' ' ' ARG . 62.7 tp -67.93 134.58 51.03 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.056 0.455 . . . . 74.349999999999994 112.103 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.91 108.64 17.02 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.291 -0.413 . . . . 75.329999999999998 111.027 174.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.75 78.67 9.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.049 0.452 . . . . 65.420000000000002 110.897 176.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -112.86 150.81 31.21 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.96 0.409 . . . . 63.310000000000002 111.2 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -77.34 171.16 15.31 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.327 0.584 . . . . 63.109999999999999 111.734 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -59.39 124.37 19.8 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.178 0.513 . . . . 35.119999999999997 111.917 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.427 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 94.4 m-20 63.36 35.42 12.28 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.731 -0.668 . . . . 65.430000000000007 112.135 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.86 137.36 57.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.367 . . . . 52.100000000000001 111.803 177.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.569 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 58.3 mtp180 -67.83 97.06 0.62 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.251 -0.431 . . . . 74.430000000000007 112.057 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 107' ' ' LEU . 33.9 m -122.04 176.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 121.325 0.583 . . . . 42.350000000000001 112.527 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -159.38 179.58 8.83 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.784 -0.644 . . . . 71.230000000000004 110.448 175.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.486 HD11 HG21 ' A' ' 59' ' ' VAL . 85.5 mt -115.45 149.44 38.03 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.579 0.585 . . . . 73.299999999999997 112.579 -173.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 48.7 mm -83.21 -73.16 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.893 -0.594 . . . . 70.200000000000003 111.094 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.48 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 23.1 m120 -121.35 87.11 44.44 Favored Pre-proline 0 N--CA 1.477 0.885 0 O-C-N 122.244 -0.285 . . . . 72.349999999999994 111.527 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.01 136.04 9.0 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 122.928 2.419 . . . . 74.349999999999994 113.577 175.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 101' ' ' LYS . 35.8 pt -128.65 134.72 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 121.037 0.446 . . . . 71.040000000000006 111.399 172.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.56 111.93 15.11 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.45 -0.341 . . . . 61.109999999999999 110.11 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.457 ' OD1' HG13 ' A' ' 86' ' ' VAL . 6.2 t0 -102.8 153.78 19.84 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.123 0.487 . . . . 74.329999999999998 111.882 -172.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.1 p -115.3 5.27 14.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.117 -0.492 . . . . 74.120000000000005 112.246 -178.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.457 HG13 ' OD1' ' A' ' 84' ' ' ASP . 6.5 m -46.61 -31.78 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.483 0.92 . . . . 63.340000000000003 113.483 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.64 0.39 15.21 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.051 0.76 . . . . 44.340000000000003 113.051 -176.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -73.59 -5.75 42.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.627 0.602 . . . . 64.349999999999994 112.627 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -94.6 -56.95 2.62 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.438 0.532 . . . . 73.140000000000001 112.438 -177.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.8 t -78.63 -25.31 45.03 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.539 0.57 . . . . 73.120000000000005 112.539 -176.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -104.91 132.47 51.1 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.01 0.433 . . . . 65.340000000000003 111.657 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -79.01 44.85 0.58 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.186 -0.461 . . . . 54.100000000000001 111.139 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.68 105.14 2.73 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 121.511 -0.376 . . . . 73.420000000000002 112.407 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -114.0 43.46 1.84 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.169 0.509 . . . . 64.099999999999994 111.523 -176.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -83.85 10.88 8.57 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.568 0.581 . . . . 64.329999999999998 112.568 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.441 HG13 ' H ' ' A' ' 97' ' ' ASP . 2.8 p -68.63 -55.66 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 N-CA-C 111.774 0.287 . . . . 74.329999999999998 111.774 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.441 ' H ' HG13 ' A' ' 96' ' ' VAL . 19.0 p-10 -148.58 106.26 3.68 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.625 0.726 . . . . 72.239999999999995 110.887 174.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.409 ' NE1' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -57.91 148.43 25.69 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.192 1.182 . . . . 75.319999999999993 114.192 -172.258 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -103.51 116.62 32.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.231 -0.895 . . . . 73.430000000000007 111.902 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.566 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 35.7 mt -105.73 104.42 16.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.353 -0.84 . . . . 64.099999999999994 110.692 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 82' ' ' ILE . 4.7 mtpm? -86.6 121.83 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 122.106 -0.371 . . . . 73.120000000000005 110.204 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.46 161.46 19.55 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.321 0.86 . . . . 61.420000000000002 113.321 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 21.5 t70 -63.91 -55.18 24.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.327 -0.851 . . . . 72.549999999999997 111.652 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -158.09 159.11 35.92 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.963 0.411 . . . . 73.109999999999999 111.364 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.48 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 57.0 mt -116.71 121.7 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.081 -0.509 . . . . 63.439999999999998 111.15 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 30.8 m -124.36 -179.13 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.401 -0.363 . . . . 74.439999999999998 110.832 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.437 ' HA ' ' HA ' ' A' ' 76' ' ' VAL . 93.9 mt -80.86 151.22 28.77 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.091 -0.381 . . . . 70.510000000000005 111.327 177.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 26.1 m -63.86 125.45 24.43 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.259 0.466 . . . . 73.409999999999997 112.259 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -80.44 108.08 13.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.996 -0.547 . . . . 74.209999999999994 111.372 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 . . . . . 0 C--O 1.256 1.398 0 N-CA-C 111.981 0.363 . . . . 64.310000000000002 111.981 179.753 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 120.823 0.344 . . . . 73.430000000000007 111.538 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -158.58 162.15 37.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.435 -0.348 . . . . 71.310000000000002 110.91 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.452 ' NE ' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -89.45 -3.37 58.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.099 0.407 . . . . 74.340000000000003 112.099 -179.627 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.452 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.3 mm? -74.82 141.39 44.3 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.715 0.293 . . . . 65.239999999999995 111.305 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 65.3 11.52 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.638 0.607 . . . . 61.219999999999999 112.638 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.98 -43.06 65.73 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.887 0.375 . . . . 61.130000000000003 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -174.43 94.75 0.1 OUTLIER Glycine 0 CA--C 1.526 0.771 0 C-N-CA 121.295 -0.478 . . . . 73.439999999999998 112.743 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.6 pt -134.69 170.01 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.937 0.398 . . . . 62.520000000000003 111.599 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -80.77 105.54 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.963 0.411 . . . . 60.509999999999998 111.002 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.574 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.0 pt? -51.59 -44.82 62.94 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.308 0.855 . . . . 72.219999999999999 113.308 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -162.57 170.08 19.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.075 0.464 . . . . 73.540000000000006 111.806 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -157.57 101.69 1.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.99 -0.55 . . . . 75.219999999999999 111.982 173.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 72.62 -53.48 0.7 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.868 0.867 . . . . 73.450000000000003 113.241 176.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.1 p -56.45 106.28 0.27 Allowed 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.152 0.427 . . . . 71.409999999999997 112.152 -178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -85.88 99.35 11.34 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.453 0.644 . . . . 64.140000000000001 111.749 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.423 ' HZ ' ' HH2' ' A' ' 98' ' ' TRP . 55.4 m-85 -84.29 117.24 23.44 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.229 -0.441 . . . . 73.140000000000001 111.473 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.652 ' HA3' ' HA3' ' A' ' 52' ' ' GLY . . . -71.34 175.69 39.36 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.104 -0.569 . . . . 41.200000000000003 112.73 176.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -53.33 112.37 0.87 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 121.451 0.643 . . . . 74.230000000000004 112.261 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 69.8 mt -85.32 133.87 34.13 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.599 -0.728 . . . . 73.219999999999999 110.743 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 90.2 mttt -126.66 127.37 45.07 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.094 0.474 . . . . 73.450000000000003 112.157 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -67.35 136.06 54.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.88 -0.6 . . . . 74.310000000000002 111.532 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.2 p -113.51 -63.51 1.44 Allowed 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.989 -0.445 . . . . 73.0 111.229 174.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.78 -173.95 4.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.077 0.465 . . . . 52.43 111.759 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 60.4 tp -92.7 124.43 36.71 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.469 -0.332 . . . . 73.430000000000007 110.764 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 25' ' ' ARG . 4.1 tpp180 -75.84 -58.1 3.48 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.864 0.364 . . . . 73.430000000000007 111.942 -177.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -168.55 141.14 2.88 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.024 0.44 . . . . 72.340000000000003 111.817 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.9 mt-10 -101.2 98.36 8.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.714 -0.476 . . . . 75.310000000000002 109.714 171.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 m -70.15 110.8 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.356 0.598 . . . . 74.519999999999996 110.209 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 81.7 mtt180 -100.34 156.32 17.31 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.513 0.56 . . . . 73.409999999999997 112.513 -171.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.73 115.43 2.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.733 -0.667 . . . . 63.340000000000003 111.844 -174.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -88.67 119.17 28.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.278 -0.419 . . . . 73.450000000000003 110.92 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -60.59 159.91 9.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.062 0.458 . . . . 73.120000000000005 111.619 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.76 -18.03 52.37 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.098 -0.501 . . . . 71.450000000000003 111.905 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -83.36 -0.11 48.35 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.185 0.439 . . . . 70.510000000000005 112.185 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -11.22 70.72 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.169 -0.539 . . . . 75.450000000000003 113.726 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -86.98 152.19 22.61 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.418 -0.46 . . . . 60.100000000000001 111.606 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.4 t -95.04 125.62 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 120.952 0.406 . . . . 60.340000000000003 111.455 -178.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -79.73 176.39 9.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.355 0.598 . . . . 54.329999999999998 111.973 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -83.68 -23.41 31.73 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.029 -0.532 . . . . 74.310000000000002 111.208 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.61 143.7 54.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.895 0.379 . . . . 74.230000000000004 111.11 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.505 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.1 mt -101.14 141.56 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 121.045 0.45 . . . . 60.549999999999997 112.16 -174.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -82.53 -50.86 8.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.396 0.617 . . . . 72.120000000000005 109.903 174.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -165.98 159.94 16.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.426 -0.806 . . . . 51.109999999999999 110.982 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.8 mtt180 -107.58 123.59 48.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.073 0.397 . . . . 72.230000000000004 112.073 -175.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.5 m -96.24 114.07 25.72 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.739 0.304 . . . . 74.129999999999995 111.382 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -101.04 156.16 17.57 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.959 0.409 . . . . 71.5 111.762 178.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.543 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 26.8 m-20 -97.65 116.78 30.52 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.033 -0.53 . . . . 72.549999999999997 111.827 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.508 HD12 HG21 ' A' ' 59' ' ' VAL . 66.9 mt -118.86 126.77 52.56 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.05 0.453 . . . . 73.129999999999995 111.003 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HD2' ' HG3' ' A' ' 56' ' ' MET . 0.5 OUTLIER -104.74 115.49 30.41 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.978 0.418 . . . . 72.010000000000005 111.272 178.603 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -80.01 105.32 11.2 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.902 0.382 . . . . 65.140000000000001 110.805 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -79.14 -21.33 46.69 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.793 0.33 . . . . 75.430000000000007 111.591 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.652 ' HA3' ' HA3' ' A' ' 17' ' ' GLY . . . -68.19 -47.03 61.27 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.038 -0.601 . . . . 74.549999999999997 112.984 176.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -96.75 -32.43 12.15 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 122.494 -0.416 . . . . 64.340000000000003 111.664 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 91.54 39.62 5.56 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.276 -0.488 . . . . 43.229999999999997 113.921 177.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -136.62 160.46 38.74 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.293 0.568 . . . . 75.430000000000007 112.319 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.562 ' HG3' ' HD2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -94.98 133.3 38.89 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.69 -0.686 . . . . 64.120000000000005 111.616 178.681 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.7 pt -126.3 141.53 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 120.636 0.255 . . . . 74.450000000000003 111.084 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -105.19 111.36 24.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.032 0.444 . . . . 75.140000000000001 110.844 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 48' ' ' LEU . 92.7 t -101.98 137.59 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.385 -0.37 . . . . 62.43 111.446 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 89.0 p -124.65 128.81 49.43 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.292 0.568 . . . . 61.219999999999999 112.048 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.499 HG21 HG13 ' A' ' 105' ' ' ILE . 29.0 pt -118.91 153.92 52.84 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 115.829 -0.623 . . . . 72.109999999999999 110.69 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.43 153.28 55.29 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.406 2.071 . . . . 72.109999999999999 113.399 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -16.92 60.17 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.152 0.427 . . . . 71.340000000000003 112.152 -178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 74.5 p -66.27 -18.8 65.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.841 0.353 . . . . 75.329999999999998 111.601 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.37 124.32 53.8 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 116.562 -0.29 . . . . 74.200000000000003 111.303 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.37 169.29 18.76 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.0 2.467 . . . . 61.109999999999999 114.141 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.0 tp -70.85 128.82 37.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.908 -0.587 . . . . 73.319999999999993 111.513 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.41 114.72 23.41 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.262 0.553 . . . . 71.319999999999993 112.294 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.96 51.91 1.42 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.716 -0.674 . . . . 61.200000000000003 111.205 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -76.71 159.03 30.53 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.325 0.584 . . . . 75.109999999999999 112.108 -177.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -77.03 148.26 36.29 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.886 -0.597 . . . . 63.0 111.334 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -59.85 119.27 7.38 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.87 0.367 . . . . 74.409999999999997 111.521 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.476 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 5.2 m-20 71.99 24.83 3.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.319 0.648 . . . . 72.310000000000002 112.387 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.97 137.3 43.44 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.549 -0.296 . . . . 52.310000000000002 110.577 171.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 19' ' ' LEU . 76.2 mtm-85 -66.85 126.62 29.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.75 0.31 . . . . 74.120000000000005 111.44 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.549 HG12 HD23 ' A' ' 107' ' ' LEU . 27.1 m -129.13 151.53 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 121.285 0.564 . . . . 60.310000000000002 112.328 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.67 157.86 43.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.182 -0.463 . . . . 73.040000000000006 110.445 174.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.8 mt -106.02 141.87 36.68 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.093 0.775 . . . . 74.230000000000004 113.093 -170.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.529 HG22 ' ND2' ' A' ' 80' ' ' ASN . 38.8 mm -97.22 118.17 43.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.619 -0.718 . . . . 72.400000000000006 110.115 174.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.529 ' ND2' HG22 ' A' ' 79' ' ' ILE . 45.4 m-80 61.55 58.33 3.15 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 123.154 0.581 . . . . 71.120000000000005 111.962 -173.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -81.82 132.52 7.6 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.753 2.302 . . . . 73.310000000000002 113.745 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.1 pt -139.36 142.22 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-O 120.764 0.316 . . . . 74.530000000000001 111.241 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.03 123.16 24.67 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.246 -0.284 . . . . 65.219999999999999 110.697 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -73.75 145.5 45.05 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.09 0.471 . . . . 62.219999999999999 111.057 -175.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 80.2 p -105.98 5.12 30.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.25 -0.432 . . . . 53.420000000000002 111.9 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.99 151.27 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.721 0.296 . . . . 43.329999999999998 111.123 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.466 ' HB1' ' CE1' ' A' ' 91' ' ' TYR . . . 71.5 -7.36 1.22 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.661 0.986 . . . . 74.340000000000003 113.661 173.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.5 p -56.27 -37.61 70.04 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.43 0.53 . . . . 75.400000000000006 112.43 -177.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.26 -11.68 34.63 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.013 0.375 . . . . 45.299999999999997 112.013 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.8 m -82.33 -38.22 24.59 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.938 0.399 . . . . 74.109999999999999 111.633 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.466 ' CE1' ' HB1' ' A' ' 87' ' ' ALA . 3.7 m-85 -75.75 -178.84 4.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.638 0.607 . . . . 64.519999999999996 112.638 -176.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.647 ' HB2' ' HB3' ' A' ' 95' ' ' ASP . 63.5 mm-40 -97.51 -179.44 4.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.63 0.604 . . . . 45.530000000000001 112.63 -169.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.73 -48.81 79.18 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-N 115.941 -0.572 . . . . 54.310000000000002 114.226 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.96 -1.79 13.72 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 122.349 -0.5 . . . . 54.32 111.921 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 92' ' ' GLN . 27.0 t70 -101.69 102.6 13.29 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.872 0.323 . . . . 61.109999999999999 111.872 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.402 ' O ' HG13 ' A' ' 96' ' ' VAL . 9.2 p -178.79 114.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 112.623 0.601 . . . . 75.420000000000002 112.623 173.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -97.0 107.85 20.46 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.191 -0.67 . . . . 64.450000000000003 109.191 167.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.423 ' HH2' ' HZ ' ' A' ' 16' ' ' PHE . 1.5 p-90 -62.32 160.18 13.73 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.464 1.283 . . . . 62.420000000000002 114.464 -167.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -114.86 144.94 42.74 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.258 -1.337 . . . . 75.209999999999994 111.423 -174.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.494 ' HB ' HG22 ' A' ' 59' ' ' VAL . 61.0 mt -129.65 122.1 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.332 -0.395 . . . . 74.510000000000005 110.97 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -89.27 149.14 23.2 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 122.081 -0.387 . . . . 73.409999999999997 110.702 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.61 161.18 42.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 65.439999999999998 111.496 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.423 ' HB3' HD22 ' A' ' 80' ' ' ASN . 30.8 t70 -84.87 -30.93 24.05 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.945 0.402 . . . . 71.439999999999998 110.986 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.417 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 25.3 t0 -161.19 153.94 20.76 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.399 0.619 . . . . 61.210000000000001 112.045 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.499 HG13 HG21 ' A' ' 61' ' ' ILE . 62.0 mt -115.11 114.18 45.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.515 -0.766 . . . . 72.540000000000006 111.178 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.2 m -123.89 178.54 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.834 0.349 . . . . 43.539999999999999 111.599 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.549 HD23 HG12 ' A' ' 76' ' ' VAL . 98.0 mt -85.12 146.33 27.19 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.785 0.326 . . . . 74.310000000000002 111.68 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.1 m -65.13 149.42 49.93 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.805 0.336 . . . . 74.329999999999998 111.152 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.0 mt -75.95 38.8 0.17 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.816 0.673 . . . . 70.409999999999997 112.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 118.993 -0.527 . . . . 72.049999999999997 111.079 174.754 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 ptp . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.897 0.379 . . . . 71.349999999999994 111.449 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.4 mmt -104.19 157.03 17.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.301 0.572 . . . . 70.310000000000002 111.674 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -95.26 96.82 9.43 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.205 -0.452 . . . . 74.109999999999999 111.07 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.411 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.3 mm? -82.23 130.92 35.21 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.51 -0.314 . . . . 65.109999999999999 111.103 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.65 165.51 24.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.536 -0.302 . . . . 41.299999999999997 111.38 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -58.24 -59.28 5.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.106 0.409 . . . . 51.240000000000002 112.106 -177.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 66.51 24.8 72.55 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.956 -0.64 . . . . 73.129999999999995 112.819 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 11' ' ' ASP . 19.8 pt -99.18 159.5 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.132 0.492 . . . . 62.210000000000001 111.956 -176.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.2 t -119.24 -62.36 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 121.186 0.517 . . . . 72.430000000000007 110.948 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.7 mt -98.08 -54.76 2.98 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.175 0.512 . . . . 54.409999999999997 110.819 179.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.454 ' O ' HD12 ' A' ' 8' ' ' ILE . 3.7 m-20 -54.72 92.26 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.193 -0.912 . . . . 74.239999999999995 112.243 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -129.8 -176.56 3.96 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.153 0.501 . . . . 61.210000000000001 111.308 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -88.02 124.49 33.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.951 0.405 . . . . 64.140000000000001 110.049 172.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.405 ' HB ' ' CE2' ' A' ' 16' ' ' PHE . 23.4 p -64.73 -19.7 65.93 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.468 0.544 . . . . 72.299999999999997 112.468 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 47.8 m 61.89 81.51 0.19 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.426 0.632 . . . . 72.239999999999995 112.343 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.405 ' CE2' ' HB ' ' A' ' 14' ' ' THR . 63.9 m-85 -132.83 136.19 46.1 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.949 -0.569 . . . . 64.120000000000005 110.888 174.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -97.52 -92.63 1.91 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 120.924 -0.655 . . . . 51.049999999999997 112.261 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.411 ' HG2' ' HD2' ' A' ' 20' ' ' LYS . 37.2 tt0 -90.27 108.84 20.01 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.923 0.392 . . . . 74.409999999999997 111.624 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.6 mt -107.78 129.72 55.03 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 110.156 -0.313 . . . . 44.520000000000003 110.156 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.605 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -118.62 139.94 50.71 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.351 0.5 . . . . 73.25 112.351 -177.92 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -77.13 142.6 39.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.926 -0.579 . . . . 62.109999999999999 111.282 176.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 46.3 t -123.72 -62.69 1.28 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.253 -0.431 . . . . 72.299999999999997 111.454 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.63 174.54 15.19 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.127 0.489 . . . . 70.329999999999998 111.858 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.8 tp -87.85 113.43 23.5 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.012 -0.54 . . . . 73.129999999999995 110.984 177.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 25' ' ' ARG . 11.6 tpp85 -61.44 -58.13 9.44 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.744 0.307 . . . . 64.340000000000003 111.443 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -176.71 143.08 0.44 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.413 0.523 . . . . 74.430000000000007 112.413 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -101.21 98.27 8.69 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.29 -0.633 . . . . 65.129999999999995 109.29 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 42' ' ' LYS . 30.0 m -77.46 126.6 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 120.898 0.38 . . . . 62.399999999999999 111.756 -175.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.572 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.5 mtt180 -96.03 158.26 15.52 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.89 0.376 . . . . 71.540000000000006 111.525 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mt -72.3 139.93 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 116.115 -0.493 . . . . 74.200000000000003 111.006 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -107.16 122.71 47.04 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.982 -0.449 . . . . 71.239999999999995 111.359 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -72.17 167.4 20.39 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.299 0.571 . . . . 51.439999999999998 112.22 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.92 -24.75 64.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.969 -0.559 . . . . 63.420000000000002 111.592 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -65.15 -14.06 59.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.002 0.429 . . . . 63.509999999999998 111.932 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.55 -3.24 83.49 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.13 -0.557 . . . . 74.400000000000006 112.535 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -98.3 148.73 23.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.212 0.53 . . . . 74.400000000000006 111.764 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.98 141.93 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.889 -0.596 . . . . 72.140000000000001 111.599 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -90.51 169.61 10.89 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.073 -0.512 . . . . 74.420000000000002 112.205 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -76.73 -26.96 55.22 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.812 -0.631 . . . . 73.140000000000001 110.895 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -77.42 146.21 36.7 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.614 0.721 . . . . 63.439999999999998 111.93 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.0 mt -99.46 144.83 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.591 -0.731 . . . . 73.310000000000002 111.068 -176.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.559 ' HB3' HG23 ' A' ' 28' ' ' VAL . 27.7 tptp -82.91 -57.62 3.22 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.304 -0.407 . . . . 64.530000000000001 111.076 177.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -168.38 160.93 11.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.916 0.388 . . . . 72.219999999999999 111.494 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -107.84 125.96 52.08 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.879 0.371 . . . . 75.310000000000002 111.912 -175.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -107.45 121.19 44.12 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.183 -0.462 . . . . 70.129999999999995 112.145 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.64 152.68 24.47 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.688 0.395 . . . . 75.319999999999993 111.989 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.643 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 11.9 m-20 -97.63 111.66 23.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.709 0.633 . . . . 73.439999999999998 112.709 177.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.1 mt -114.65 128.49 56.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.982 -0.553 . . . . 64.049999999999997 110.344 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.643 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 2.4 mptp? -120.29 145.95 46.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.957 0.408 . . . . 71.430000000000007 111.592 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -112.41 131.02 55.77 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 116.183 -0.462 . . . . 74.030000000000001 110.859 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -82.38 169.78 16.06 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.901 0.381 . . . . 74.099999999999994 111.807 -177.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.29 -74.86 1.01 Allowed Glycine 0 CA--C 1.524 0.602 0 C-N-CA 121.275 -0.488 . . . . 71.5 112.724 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.484 ' HG3' ' HG3' ' A' ' 55' ' ' ARG . 6.9 tp-100 -65.11 -28.84 69.72 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.16 0.505 . . . . 73.230000000000004 110.291 174.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.58 52.6 33.51 Favored Glycine 0 CA--C 1.526 0.738 0 CA-C-N 115.874 -0.603 . . . . 65.310000000000002 114.317 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.484 ' HG3' ' HG3' ' A' ' 53' ' ' GLN . 49.9 mtt180 -122.53 135.55 54.67 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.264 -0.551 . . . . 64.439999999999998 111.194 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.9 ptt? -111.37 141.25 45.16 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.077 -0.511 . . . . 63.119999999999997 111.516 -176.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 22.4 pt -133.49 137.32 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.164 -0.471 . . . . 72.030000000000001 111.565 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.07 114.09 26.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.784 0.326 . . . . 73.510000000000005 110.84 175.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 87.7 t -94.97 119.32 42.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.771 0.319 . . . . 62.140000000000001 111.573 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.6 m -108.68 114.76 28.83 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.999 0.428 . . . . 53.130000000000003 111.894 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 pt -108.09 154.09 41.41 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.117 -0.492 . . . . 74.299999999999997 111.079 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.57 146.78 51.74 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.747 2.298 . . . . 60.329999999999998 113.486 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.25 64.72 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.128 0.788 . . . . 72.120000000000005 113.128 -175.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 t -68.99 -19.21 64.14 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.998 0.428 . . . . 73.120000000000005 111.386 177.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.3 t -87.1 127.08 60.68 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.406 -0.361 . . . . 74.140000000000001 110.864 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.5 177.94 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.722 2.281 . . . . 72.230000000000004 113.886 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.0 tp -79.92 126.51 31.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.794 -0.639 . . . . 63.420000000000002 111.894 -175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -80.61 122.85 27.58 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.2 0.524 . . . . 75.420000000000002 111.74 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.31 76.88 1.74 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.129 0.49 . . . . 42.310000000000002 111.075 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -90.04 -172.51 3.53 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.134 0.492 . . . . 73.25 112.126 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -118.11 161.6 19.57 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 116.275 -0.42 . . . . 72.439999999999998 111.384 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.34 124.39 20.78 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.873 0.368 . . . . 70.329999999999998 111.276 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.605 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 41.9 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 112.74 0.645 . . . . 73.209999999999994 112.74 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.66 124.91 25.39 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.302 -0.249 . . . . 31.449999999999999 110.88 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -63.21 122.48 16.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.052 0.453 . . . . 54.329999999999998 111.527 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.473 HG12 HD23 ' A' ' 107' ' ' LEU . 27.6 m -126.14 140.18 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.12 0.486 . . . . 74.400000000000006 111.291 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 108' ' ' THR . 12.7 pt-20 -121.75 152.6 39.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.302 0.572 . . . . 73.109999999999999 111.126 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.6 mt -101.19 145.39 28.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.884 -0.598 . . . . 63.420000000000002 111.378 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -75.48 -70.98 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.561 -0.29 . . . . 74.019999999999996 110.664 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -122.81 86.03 50.01 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-O 120.72 0.295 . . . . 72.420000000000002 111.477 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.55 150.14 14.77 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.976 2.45 . . . . 60.32 113.502 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.1 pt -140.97 132.36 28.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 73.109999999999999 110.637 171.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.96 125.02 28.83 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 116.575 -0.284 . . . . 64.030000000000001 110.96 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -83.19 121.58 27.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.148 0.499 . . . . 73.409999999999997 111.105 -177.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.1 p -113.2 -1.04 14.44 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.08 -0.509 . . . . 71.420000000000002 111.68 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.4 m -92.48 -13.65 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.121 0.415 . . . . 74.109999999999999 112.121 -175.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.09 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.054 0.454 . . . . 42.399999999999999 112.07 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.1 p -76.09 46.98 0.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 122.97 0.508 . . . . 40.409999999999997 112.202 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.43 104.45 3.92 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.205 -0.31 . . . . 22.149999999999999 111.584 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.0 m 72.97 -45.57 0.63 Allowed 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 113.079 0.77 . . . . 70.519999999999996 113.079 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -56.11 -47.78 77.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.904 0.705 . . . . 75.340000000000003 112.904 -173.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -145.84 130.76 18.18 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.224 -0.298 . . . . 75.420000000000002 111.439 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -98.7 -34.02 5.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 121.301 -0.476 . . . . 45.340000000000003 113.41 177.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.03 152.2 19.44 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.923 0.392 . . . . 74.409999999999997 111.699 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.11 101.45 5.33 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 121.042 0.449 . . . . 71.299999999999997 111.924 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.35 -161.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 116.355 -0.384 . . . . 72.450000000000003 111.467 -178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -61.74 117.74 6.22 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.338 0.59 . . . . 72.040000000000006 111.301 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 8.8 p-90 -98.44 172.26 7.64 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.031 0.752 . . . . 73.430000000000007 113.031 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -112.68 140.43 47.45 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.134 0.79 . . . . 65.239999999999995 113.134 -172.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 57.2 mt -123.33 113.46 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.209 -0.905 . . . . 75.329999999999998 110.39 173.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -84.39 136.22 33.96 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.157 -0.339 . . . . 73.010000000000005 110.246 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.94 164.48 30.07 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.263 0.838 . . . . 53.439999999999998 113.263 -173.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.54 -66.65 0.63 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.259 -0.882 . . . . 73.510000000000005 111.183 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -141.37 162.46 35.43 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.084 0.468 . . . . 74.25 111.572 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 37.4 mt -125.87 121.46 59.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.812 -0.631 . . . . 55.109999999999999 110.979 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.1 m -130.99 172.15 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 120.745 0.307 . . . . 71.010000000000005 111.55 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.473 HD23 HG12 ' A' ' 76' ' ' VAL . 92.3 mt -76.74 135.82 39.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.602 0.239 . . . . 71.329999999999998 111.25 177.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 110' ' ' GLU . 6.2 m -67.2 134.69 52.2 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.512 -0.313 . . . . 70.200000000000003 111.371 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.33 3.95 9.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 112.214 0.45 . . . . 62.109999999999999 112.214 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.469 ' H ' HG22 ' A' ' 108' ' ' THR . 31.8 mm-40 . . . . . 0 C--O 1.253 1.26 0 CA-C-O 118.732 -0.651 . . . . 72.439999999999998 112.136 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 112.323 0.49 . . . . 74.319999999999993 112.323 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.6 mmt -111.89 178.66 4.24 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.147 -0.345 . . . . 73.409999999999997 111.606 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.444 HH11 ' HD3' ' A' ' 3' ' ' ARG . 15.5 ttm180 -93.48 97.89 10.83 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.858 0.361 . . . . 65.209999999999994 111.375 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.494 ' HG ' HD13 ' A' ' 8' ' ' ILE . 3.1 mm? -120.59 173.41 7.2 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.971 0.415 . . . . 50.219999999999999 111.034 177.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -137.25 -69.4 0.46 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.875 0.369 . . . . 73.409999999999997 111.929 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -155.42 175.55 13.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.882 0.372 . . . . 72.409999999999997 111.529 -177.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.0 -29.11 4.77 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.307 -0.473 . . . . 40.100000000000001 113.374 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.494 HD13 ' HG ' ' A' ' 4' ' ' LEU . 43.8 pt -81.12 -179.75 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.178 0.513 . . . . 61.119999999999997 112.099 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 9' ' ' VAL . 5.6 p -73.75 89.76 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.79 0.805 . . . . 74.319999999999993 110.974 174.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.625 HD12 ' N ' ' A' ' 11' ' ' ASP . 1.6 pp -77.1 -31.65 56.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.962 -0.563 . . . . 75.319999999999993 111.831 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.625 ' N ' HD12 ' A' ' 10' ' ' LEU . 21.7 t0 46.59 63.84 1.75 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.421 0.629 . . . . 64.409999999999997 111.512 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -101.14 127.65 47.58 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.8 -0.636 . . . . 70.150000000000006 112.006 -172.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.17 94.78 0.53 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.652 0.263 . . . . 73.319999999999993 111.207 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.1 t -71.69 -33.21 68.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.944 0.402 . . . . 62.399999999999999 111.364 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 m -113.72 124.98 53.58 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.254 -0.43 . . . . 55.399999999999999 110.537 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -79.71 140.17 37.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.775 0.322 . . . . 70.239999999999995 111.648 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.87 -178.27 17.23 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 120.981 -0.628 . . . . 61.509999999999998 112.599 173.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.88 130.85 30.21 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.582 0.706 . . . . 73.109999999999999 112.632 -178.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 mt -94.67 148.11 22.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.791 -0.64 . . . . 70.409999999999997 110.987 -178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 61.1 mttp -114.31 118.17 33.16 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.093 0.473 . . . . 61.130000000000003 112.082 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.39 115.07 13.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.029 -0.532 . . . . 72.329999999999998 111.391 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.2 p -99.25 -60.87 1.45 Allowed 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.075 0.398 . . . . 63.100000000000001 112.075 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.25 177.88 10.57 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.863 0.69 . . . . 65.200000000000003 112.863 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.3 tp -81.98 119.52 24.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.477 -0.783 . . . . 74.510000000000005 110.604 173.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 8.5 tpt180 -74.89 -55.76 5.46 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.064 0.394 . . . . 72.430000000000007 112.064 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -170.67 143.1 2.11 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.897 0.332 . . . . 72.409999999999997 111.897 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -110.49 118.96 37.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.747 0.308 . . . . 73.299999999999997 110.588 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.9 m -96.73 117.71 41.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 121.021 0.439 . . . . 65.329999999999998 110.619 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.615 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 78.5 mtt180 -91.76 179.52 5.61 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.363 0.601 . . . . 75.219999999999999 112.511 -175.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.0 mt -97.83 114.22 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.633 -0.712 . . . . 64.450000000000003 110.989 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.3 tt0 -81.28 130.2 34.93 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.284 0.564 . . . . 73.219999999999999 111.527 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.453 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.4 m-20 -80.63 145.78 31.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.792 -0.64 . . . . 74.010000000000005 110.682 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -63.36 -18.12 63.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.118 0.485 . . . . 73.329999999999998 111.166 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.35 -17.91 63.09 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.937 -0.574 . . . . 72.430000000000007 111.703 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.01 -49.15 0.89 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.379 -0.439 . . . . 55.240000000000002 113.175 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.5 m -74.45 155.92 37.52 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.067 0.461 . . . . 75.409999999999997 111.638 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 40.4 t -96.39 124.33 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.489 -0.323 . . . . 75.420000000000002 111.314 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.453 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 47.8 t -59.68 164.46 3.62 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.809 0.67 . . . . 54.149999999999999 112.809 -177.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.615 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 10.2 m-20 -81.56 -2.72 51.02 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.963 -0.562 . . . . 74.019999999999996 110.659 171.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.85 124.84 27.59 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.057 -0.52 . . . . 74.099999999999994 109.949 170.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 48.9 mt -95.46 140.88 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.748 0.309 . . . . 73.530000000000001 110.854 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -87.27 -59.55 2.22 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.724 0.297 . . . . 62.219999999999999 110.963 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -137.64 161.05 37.5 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.402 0.62 . . . . 71.519999999999996 111.772 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -132.61 111.24 11.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.68 -0.691 . . . . 65.349999999999994 110.856 -177.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 31.0 m -95.14 131.65 40.92 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.409 0.522 . . . . 74.230000000000004 112.409 -175.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -113.33 152.2 30.22 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.772 0.429 . . . . 72.329999999999998 111.444 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.516 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 48.8 m-20 -88.11 110.11 20.4 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.283 -0.417 . . . . 73.310000000000002 111.217 174.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.652 HD12 HG21 ' A' ' 59' ' ' VAL . 41.2 mt -114.53 130.63 56.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.993 0.425 . . . . 62.140000000000001 110.847 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.0 mmtm -87.29 118.03 26.44 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.83 0.348 . . . . 74.340000000000003 110.832 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t -95.15 146.37 24.36 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.323 0.582 . . . . 73.340000000000003 112.399 -176.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -89.51 2.72 54.21 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.904 -0.589 . . . . 63.329999999999998 111.387 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 -107.76 0.07 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.159 -0.543 . . . . 63.109999999999999 113.24 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -78.84 14.01 1.51 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 122.153 -0.616 . . . . 75.230000000000004 112.43 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.84 -5.13 49.78 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.007 -0.616 . . . . 61.140000000000001 113.788 177.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -78.7 146.78 33.78 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.974 0.416 . . . . 74.450000000000003 111.696 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -70.07 132.75 46.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.038 -0.528 . . . . 51.409999999999997 109.815 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.455 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 34.0 pt -103.48 118.11 50.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.126 0.489 . . . . 62.049999999999997 110.838 177.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -87.4 104.33 16.34 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.097 0.475 . . . . 74.420000000000002 109.741 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.652 HG21 HD12 ' A' ' 48' ' ' LEU . 90.3 t -94.39 119.74 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-O 121.105 0.479 . . . . 74.310000000000002 112.25 -172.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.2 m -106.7 121.97 45.41 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.994 -0.548 . . . . 71.239999999999995 111.29 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.451 HG21 HG13 ' A' ' 105' ' ' ILE . 36.9 pt -119.33 145.91 39.68 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 116.657 -0.247 . . . . 65.409999999999997 110.62 174.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.47 134.64 64.8 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.113 1.875 . . . . 75.209999999999994 112.261 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.76 -7.17 6.99 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.805 0.669 . . . . 65.25 112.805 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.5 p -70.46 -20.06 62.91 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 120.719 0.295 . . . . 51.219999999999999 110.883 173.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.5 t -82.1 133.47 51.07 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.981 -0.554 . . . . 65.209999999999994 110.747 175.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.64 151.19 7.9 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.14 2.56 . . . . 63.439999999999998 114.421 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 68.2 tp -63.96 136.34 57.26 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.926 -0.579 . . . . 73.200000000000003 112.197 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -92.52 125.21 37.06 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.15 0.5 . . . . 45.43 111.339 175.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -113.29 72.01 0.76 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.923 -0.58 . . . . 74.510000000000005 111.007 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -102.87 170.32 8.06 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.412 0.625 . . . . 72.400000000000006 111.856 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.6 168.34 10.59 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.54 -0.755 . . . . 74.310000000000002 111.496 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.23 130.68 44.05 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.912 0.387 . . . . 71.129999999999995 111.851 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.419 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 96.3 m-20 62.12 21.98 12.8 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.225 0.61 . . . . 71.310000000000002 112.222 -177.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.16 127.95 34.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.621 0.248 . . . . 70.120000000000005 111.038 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -62.05 116.26 4.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.125 0.488 . . . . 75.239999999999995 111.593 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 HD23 ' A' ' 107' ' ' LEU . 29.5 m -129.09 152.87 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.073 -0.512 . . . . 73.329999999999998 111.888 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.08 152.55 50.98 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.086 0.469 . . . . 73.120000000000005 110.461 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.0 mt -98.19 144.96 27.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.167 0.803 . . . . 60.109999999999999 113.167 -170.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.6 mm -92.37 113.51 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.378 -0.828 . . . . 75.439999999999998 110.31 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.2 m120 48.3 67.69 4.25 Favored Pre-proline 0 N--CA 1.48 1.041 0 N-CA-C 112.776 0.658 . . . . 71.239999999999995 112.776 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.49 146.27 15.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.869 2.379 . . . . 71.420000000000002 113.429 177.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 46.8 pt -136.81 140.95 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 122.659 0.384 . . . . 72.519999999999996 111.002 176.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.35 124.9 25.31 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.188 -0.32 . . . . 61.32 110.709 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -64.17 104.63 0.76 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.469 0.652 . . . . 33.539999999999999 111.25 -175.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.8 t -81.31 -34.8 31.67 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.724 -0.671 . . . . 75.439999999999998 112.483 -178.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.473 ' O ' HG22 ' A' ' 90' ' ' THR . 21.6 m -70.14 -35.86 65.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 111.942 0.349 . . . . 73.409999999999997 111.942 -174.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.62 -54.36 46.88 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 111.724 0.268 . . . . 70.420000000000002 111.724 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.8 t -73.67 -26.51 60.77 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 111.872 0.323 . . . . 70.340000000000003 111.872 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.42 -40.9 98.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.816 0.341 . . . . 50.039999999999999 111.369 177.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.473 HG22 ' O ' ' A' ' 86' ' ' VAL . 10.2 t -90.68 -35.92 14.65 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.81 0.3 . . . . 73.549999999999997 111.81 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -104.97 99.1 8.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.943 0.402 . . . . 74.549999999999997 110.913 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.418 ' CD ' ' H ' ' A' ' 92' ' ' GLN . 0.8 OUTLIER -86.66 -5.69 59.06 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.493 -0.321 . . . . 74.010000000000005 111.844 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -75.03 161.17 53.18 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 121.251 -0.5 . . . . 73.25 113.235 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.49 -3.28 58.99 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.478 -0.425 . . . . 74.010000000000005 112.11 -178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -56.75 -45.02 82.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.772 0.429 . . . . 54.039999999999999 112.074 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 49.0 t -83.45 113.65 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 N-CA-C 112.109 0.411 . . . . 61.030000000000001 112.109 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -71.42 159.2 34.96 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 109.238 -0.653 . . . . 63.130000000000003 109.238 172.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.455 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -78.89 142.47 36.75 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 122.309 1.052 . . . . 75.530000000000001 113.681 -166.428 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -107.08 148.38 28.85 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.741 -1.118 . . . . 65.400000000000006 111.237 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 38.2 mt -123.53 113.54 37.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 110.052 -0.351 . . . . 50.109999999999999 110.052 174.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -85.35 132.64 34.21 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 122.224 -0.297 . . . . 54.439999999999998 110.691 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -127.13 151.14 49.05 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.335 0.494 . . . . 72.530000000000001 112.335 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.16 -31.29 67.51 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.066 -0.515 . . . . 71.540000000000006 110.777 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -167.03 161.26 14.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.015 -0.539 . . . . 75.230000000000004 111.413 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.451 HG13 HG21 ' A' ' 61' ' ' ILE . 42.2 mt -122.83 116.71 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.356 -0.384 . . . . 74.299999999999997 111.174 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.2 m -124.35 171.32 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.903 0.383 . . . . 73.019999999999996 111.478 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.523 HD23 HG12 ' A' ' 76' ' ' VAL . 97.5 mt -75.62 145.34 41.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.479 -0.328 . . . . 63.509999999999998 110.809 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 m -65.8 148.66 51.42 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.663 0.268 . . . . 61.200000000000003 110.974 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 83.8 mt -64.66 0.76 1.01 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 112.728 0.64 . . . . 63.439999999999998 112.728 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.757 -0.64 . . . . 74.319999999999993 111.692 177.079 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.715 0.293 . . . . 62.240000000000002 111.112 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.49 ' N ' ' SD ' ' A' ' 2' ' ' MET . 1.1 mpt? -73.52 177.06 5.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.201 0.524 . . . . 65.519999999999996 111.313 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -93.46 89.32 6.26 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.198 0.523 . . . . 73.010000000000005 110.358 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.51 133.89 38.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.89 -0.595 . . . . 72.209999999999994 111.97 -176.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.553 ' HB3' ' HB2' ' A' ' 103' ' ' ASP . . . -84.36 95.5 8.76 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.943 0.402 . . . . 54.240000000000002 111.559 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -96.13 116.31 28.78 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.922 0.391 . . . . 74.400000000000006 111.443 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -152.55 62.82 0.38 Allowed Glycine 0 CA--C 1.527 0.836 0 CA-C-N 115.846 -0.615 . . . . 73.510000000000005 112.104 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 27.5 pt -62.6 128.61 24.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.302 0.572 . . . . 75.540000000000006 112.211 -177.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 12.7 p -141.25 160.33 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.166 -0.47 . . . . 71.430000000000007 111.315 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.511 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.2 pt? -116.8 -49.36 2.63 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.682 0.277 . . . . 73.230000000000004 111.162 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.2 122.16 29.81 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 110.002 -0.37 . . . . 65.530000000000001 110.002 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -152.14 126.59 9.38 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.285 0.564 . . . . 71.230000000000004 112.096 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -86.59 122.98 31.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.732 -0.667 . . . . 65.239999999999995 111.181 -178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.9 p -72.49 69.03 0.83 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.395 0.617 . . . . 63.219999999999999 111.522 176.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -80.63 -35.85 33.39 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.066 -0.515 . . . . 53.350000000000001 111.641 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -76.06 112.28 12.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.752 0.311 . . . . 72.120000000000005 111.188 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 170.08 19.5 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.777 -0.725 . . . . 74.099999999999994 112.124 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -45.14 108.28 0.12 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.342 0.497 . . . . 60.200000000000003 112.342 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 92.1 mt -77.38 133.03 38.8 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.133 -0.485 . . . . 75.420000000000002 110.643 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.495 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 7.1 mtmp? -136.21 140.82 43.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.52 -0.309 . . . . 73.230000000000004 111.305 -176.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -65.4 135.48 55.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.095 0.406 . . . . 73.140000000000001 112.095 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.0 m -116.14 -63.96 1.38 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.835 0.35 . . . . 72.140000000000001 111.428 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.26 -173.68 4.15 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.043 0.449 . . . . 63.549999999999997 111.747 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.6 tp -102.09 127.24 49.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.393 -0.367 . . . . 61.520000000000003 110.177 171.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -79.63 -68.47 0.66 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.969 0.414 . . . . 75.400000000000006 111.951 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -163.42 145.6 9.8 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.275 0.472 . . . . 71.549999999999997 112.275 -171.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -106.67 103.1 12.46 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.286 -0.416 . . . . 62.109999999999999 110.911 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 m -76.6 109.98 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.344 0.592 . . . . 63.32 111.172 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 70.0 mtp180 -92.67 170.43 9.72 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.2 -0.455 . . . . 70.25 111.957 -174.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 40' ' ' GLU . 48.6 mt -80.82 144.18 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.484 -0.325 . . . . 73.219999999999999 111.1 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -110.48 133.25 53.46 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.767 0.318 . . . . 64.450000000000003 111.028 176.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.6 m-20 -79.68 162.43 25.23 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.49 0.552 . . . . 74.030000000000001 112.49 -175.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.89 -38.71 67.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.73 -0.668 . . . . 65.310000000000002 110.869 174.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.25 -37.44 67.22 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.534 -0.757 . . . . 73.409999999999997 111.539 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.25 -32.18 4.99 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 116.061 -0.518 . . . . 60.310000000000002 111.952 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 54.8 m -62.7 166.54 5.33 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.055 0.455 . . . . 75.120000000000005 111.737 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.31 146.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.933 0.397 . . . . 73.140000000000001 111.507 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 32.7 t -94.65 156.62 16.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.093 0.473 . . . . 72.439999999999998 111.508 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.452 ' HA ' ' NH2' ' A' ' 29' ' ' ARG . 13.5 t70 -67.06 -31.56 72.15 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.177 -0.465 . . . . 64.140000000000001 111.043 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.439 ' HB2' HD12 ' A' ' 30' ' ' ILE . 16.9 mm-40 -73.45 152.53 40.73 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.434 0.635 . . . . 73.129999999999995 112.008 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 56.9 mt -114.56 147.17 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.972 -0.558 . . . . 53.329999999999998 111.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.57 -60.51 2.23 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.064 0.459 . . . . 72.519999999999996 111.411 176.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -147.04 167.44 24.06 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.105 -0.498 . . . . 73.349999999999994 111.019 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -128.93 118.21 22.26 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.243 -0.435 . . . . 73.040000000000006 110.739 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.2 m -95.76 124.97 40.02 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.385 0.513 . . . . 72.319999999999993 112.385 -175.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -106.4 167.87 9.54 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.086 0.47 . . . . 72.530000000000001 111.568 177.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -112.38 116.15 29.87 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.78 -0.646 . . . . 74.25 111.031 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -121.6 121.06 36.57 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 73.209999999999994 111.238 178.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 56' ' ' MET . 20.2 ptmt -96.45 128.47 43.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.395 0.617 . . . . 62.350000000000001 111.603 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.9 t -88.63 150.37 23.06 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.175 0.512 . . . . 65.310000000000002 111.893 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -78.37 118.8 20.89 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.14 -0.482 . . . . 73.109999999999999 110.945 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 143.14 -77.84 0.28 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.335 -0.459 . . . . 61.399999999999999 112.393 -177.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -95.52 -5.66 42.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.046 0.387 . . . . 72.319999999999993 112.046 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.97 0.9 54.33 Favored Glycine 0 CA--C 1.532 1.11 0 N-CA-C 114.448 0.539 . . . . 51.420000000000002 114.448 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 -79.43 153.98 29.28 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 117.282 0.541 . . . . 72.150000000000006 111.582 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.484 ' HA ' ' HA ' ' A' ' 49' ' ' LYS . 22.8 ptp -105.45 144.11 32.68 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.903 -0.59 . . . . 63.5 111.441 176.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 100' ' ' ILE . 24.0 pt -106.06 144.62 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 116.103 -0.499 . . . . 62.140000000000001 110.598 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -87.74 105.43 17.38 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.836 0.35 . . . . 62.530000000000001 111.017 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.47 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -101.1 119.62 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 N-CA-C 112.218 0.451 . . . . 74.319999999999993 112.218 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.538 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 39.2 m -106.79 129.13 54.7 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.989 0.423 . . . . 43.130000000000003 111.623 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.9 pt -126.7 149.85 69.52 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 116.508 -0.315 . . . . 64.409999999999997 110.645 174.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -55.69 141.82 83.54 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.486 2.124 . . . . 73.310000000000002 112.843 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.27 -18.13 34.74 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.59 0.589 . . . . 65.230000000000004 112.59 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 45.1 t -62.38 -27.95 69.43 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.851 0.358 . . . . 63.409999999999997 111.484 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.7 t -77.08 128.58 80.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 116.512 -0.313 . . . . 73.25 111.034 178.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 155.42 33.45 Favored 'Trans proline' 0 CA--C 1.544 1.008 0 C-N-CA 122.797 2.331 . . . . 62.43 113.667 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.52 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 26.7 tp -67.89 134.42 50.82 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.095 -0.502 . . . . 64.430000000000007 111.749 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.414 ' H ' HD12 ' A' ' 67' ' ' LEU . 61.1 mmtt -83.74 -70.99 0.53 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.844 0.683 . . . . 74.329999999999998 112.844 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.52 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 50.6 mt-10 55.6 49.85 15.68 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 120.702 0.287 . . . . 71.430000000000007 111.608 -175.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -66.65 169.56 7.6 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.119 0.485 . . . . 75.230000000000004 112.072 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 3.9 m-20 -60.66 138.3 58.09 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.994 -0.548 . . . . 74.219999999999999 111.061 176.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -62.68 125.31 23.51 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 116.389 -0.369 . . . . 71.010000000000005 111.615 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 69.32 17.63 8.18 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.593 0.757 . . . . 70.209999999999994 112.914 -176.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.541 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -80.21 146.33 31.79 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.991 -0.443 . . . . 71.209999999999994 111.265 175.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 75.4 mtt180 -69.99 114.81 8.52 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.046 0.45 . . . . 74.430000000000007 111.681 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.554 HG12 HD23 ' A' ' 107' ' ' LEU . 27.4 m -126.93 140.42 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.075 -0.511 . . . . 74.329999999999998 111.146 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.7 pt-20 -121.66 155.9 34.16 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.242 0.544 . . . . 74.430000000000007 111.331 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -98.86 122.14 41.72 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.373 0.509 . . . . 60.530000000000001 112.373 -174.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -72.5 108.53 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 115.956 -0.565 . . . . 74.109999999999999 110.331 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 55.57 67.02 3.27 Favored Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 112.817 0.673 . . . . 74.109999999999999 112.817 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.87 137.7 10.03 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.778 2.318 . . . . 63.240000000000002 113.633 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 101' ' ' LYS . 40.1 pt -120.59 141.95 38.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 121.029 0.442 . . . . 73.019999999999996 110.995 174.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.72 129.0 36.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.611 -0.268 . . . . 72.120000000000005 110.468 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.446 ' OD1' HG22 ' A' ' 86' ' ' VAL . 7.1 t0 -73.08 132.64 43.57 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.277 0.56 . . . . 74.219999999999999 111.998 -174.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 32.5 m -67.21 -42.5 84.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.797 -0.638 . . . . 62.25 112.411 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.446 HG22 ' OD1' ' A' ' 84' ' ' ASP . 16.6 m -60.24 -16.93 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 112.183 0.438 . . . . 73.340000000000003 112.183 -174.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -106.08 -56.66 2.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.961 0.41 . . . . 73.349999999999994 111.679 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.1 p -68.46 -15.46 63.56 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.773 0.657 . . . . 71.340000000000003 112.773 -175.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.43 9.62 35.6 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.896 0.379 . . . . 73.209999999999994 111.848 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.7 m -120.28 -32.86 4.03 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.173 0.511 . . . . 71.319999999999993 110.829 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.643 ' HB3' ' HB3' ' A' ' 94' ' ' ALA . 49.3 m-85 -93.32 113.8 26.07 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.079 -0.51 . . . . 75.420000000000002 111.477 177.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -61.72 96.67 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.554 -0.293 . . . . 72.420000000000002 111.767 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 53.5 32.26 45.43 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.416 -0.356 . . . . 33.100000000000001 113.793 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.643 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . . . -121.64 114.03 20.58 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.074 0.464 . . . . 54.030000000000001 111.954 -177.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -84.98 31.36 0.55 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.063 0.459 . . . . 61.340000000000003 111.725 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.51 HG23 ' HB1' ' A' ' 94' ' ' ALA . 59.4 t -63.42 99.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 112.419 0.525 . . . . 34.420000000000002 112.419 -174.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 54.74 33.94 20.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.224 0.535 . . . . 75.25 111.886 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.85 160.68 19.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.754 1.02 . . . . 75.450000000000003 113.754 -174.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -107.32 143.92 34.91 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.828 -1.078 . . . . 72.109999999999999 111.614 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 57' ' ' ILE . 63.2 mt -131.87 131.68 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.976 -0.556 . . . . 72.439999999999998 110.315 176.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.538 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 32.9 mtmm -109.14 126.03 52.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.761 0.315 . . . . 75.099999999999994 111.228 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.76 162.95 16.88 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.5 0.556 . . . . 72.450000000000003 112.5 -173.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' A' ' 5' ' ' ALA . 32.1 t70 -73.27 -29.15 62.54 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.583 -0.735 . . . . 73.400000000000006 110.542 176.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -174.45 162.63 3.53 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.995 -0.548 . . . . 74.319999999999993 111.266 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 34.2 mt -118.98 119.92 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.44 -0.345 . . . . 71.530000000000001 110.665 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.72 174.13 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-O 120.905 0.384 . . . . 74.219999999999999 111.834 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.554 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -77.53 132.29 38.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.66 -0.246 . . . . 70.400000000000006 111.023 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 87.6 m -55.78 141.41 38.62 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.108 0.41 . . . . 73.340000000000003 112.108 -177.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.65 85.65 0.11 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.09 0.471 . . . . 71.329999999999998 111.642 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-N 116.377 -0.374 . . . . 74.230000000000004 111.414 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.64 0.257 . . . . 71.430000000000007 111.416 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.423 ' N ' ' SD ' ' A' ' 2' ' ' MET . 1.3 mpt? -77.37 100.02 5.79 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.668 0.618 . . . . 74.230000000000004 112.668 -176.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -122.89 140.25 53.17 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.483 -0.326 . . . . 72.230000000000004 110.896 171.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.429 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.1 mm? -99.0 147.72 24.73 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.663 0.268 . . . . 75.230000000000004 110.838 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -94.92 119.3 33.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.778 0.323 . . . . 70.109999999999999 111.439 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -68.12 -39.46 82.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.854 0.359 . . . . 60.350000000000001 111.698 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.71 94.23 1.15 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.252 -0.499 . . . . 60.030000000000001 113.538 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.6 pt -97.56 167.89 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 120.973 0.416 . . . . 50.310000000000002 111.227 176.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.11 108.39 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.987 0.422 . . . . 73.120000000000005 111.262 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.808 HD13 ' HG2' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -145.61 171.26 14.96 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.194 -0.457 . . . . 72.310000000000002 111.937 -179.227 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -104.88 22.53 15.04 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.491 0.552 . . . . 73.319999999999993 112.491 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.808 ' HG2' HD13 ' A' ' 10' ' ' LEU . 13.6 ptmm? -62.43 -40.1 95.47 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.404 0.52 . . . . 65.109999999999999 112.404 -176.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -100.68 112.45 24.84 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.075 0.464 . . . . 74.430000000000007 111.588 -177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -84.99 -170.27 3.05 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.175 -0.466 . . . . 75.310000000000002 111.956 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -87.01 139.78 30.23 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.009 0.433 . . . . 73.519999999999996 112.113 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -97.46 163.78 12.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.274 -0.421 . . . . 70.140000000000001 111.201 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.85 -151.6 9.14 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.982 -0.627 . . . . 72.049999999999997 112.71 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HG2' ' HG3' ' A' ' 51' ' ' LYS . 11.6 pt-20 -62.73 109.04 1.29 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.41 0.624 . . . . 74.329999999999998 111.255 178.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.8 mt -80.37 119.16 22.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.435 . . . . 71.349999999999994 110.189 175.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 73' ' ' ASN . 9.0 mtpm? -101.63 120.88 41.02 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.129 0.49 . . . . 71.349999999999994 111.729 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.482 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 35.7 t80 -59.34 115.21 3.09 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.454 -0.793 . . . . 72.299999999999997 110.371 173.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.479 ' OG ' ' HG2' ' A' ' 49' ' ' LYS . 49.7 m -98.69 -64.42 1.04 Allowed 'General case' 0 N--CA 1.474 0.735 0 O-C-N 122.12 -0.362 . . . . 65.340000000000003 111.958 -178.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.28 176.96 11.12 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.287 0.565 . . . . 52.520000000000003 112.257 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.3 tp -91.25 107.32 19.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.809 -0.632 . . . . 70.019999999999996 110.513 175.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -61.66 -59.2 5.55 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.43 -0.35 . . . . 73.540000000000006 111.7 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -173.26 130.51 0.47 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.508 0.559 . . . . 74.409999999999997 112.508 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -98.58 99.54 10.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.99 -0.55 . . . . 73.420000000000002 110.102 171.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 m -77.71 115.54 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.027 0.442 . . . . 61.5 111.285 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.565 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 78.8 mtt85 -87.29 168.45 13.18 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.265 0.555 . . . . 73.219999999999999 112.153 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.3 mt -79.4 122.15 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 60.200000000000003 111.786 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -91.94 112.59 24.58 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.9 0.381 . . . . 71.120000000000005 111.035 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -59.17 162.88 4.1 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.64 0.608 . . . . 65.120000000000005 112.64 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.35 -32.7 57.46 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 116.171 -0.468 . . . . 65.310000000000002 111.345 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.14 -7.26 22.05 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.493 0.553 . . . . 54.299999999999997 112.493 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 93.33 -10.28 73.42 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.234 -0.508 . . . . 73.239999999999995 113.27 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -93.4 145.41 24.5 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.39 -0.476 . . . . 40.439999999999998 111.518 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 28.9 t -75.49 151.72 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.525 -0.307 . . . . 74.540000000000006 111.521 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -105.1 170.99 7.56 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.09 0.471 . . . . 72.400000000000006 111.679 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.26 -28.25 64.02 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.993 -0.549 . . . . 71.439999999999998 110.945 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -74.96 146.15 41.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.313 0.577 . . . . 71.120000000000005 112.225 -177.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 51.3 mt -99.0 153.63 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 115.655 -0.702 . . . . 74.540000000000006 111.348 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 24.0 tptm -108.83 -58.64 1.99 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.859 0.362 . . . . 70.340000000000003 111.359 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.6 mt-10 -136.33 139.97 42.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.057 0.456 . . . . 72.530000000000001 111.286 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -107.53 112.43 25.19 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 116.347 -0.388 . . . . 74.310000000000002 111.203 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.6 m -103.64 122.23 44.58 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.702 0.63 . . . . 72.230000000000004 112.702 -177.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -105.83 161.16 14.67 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.341 0.656 . . . . 73.219999999999999 111.574 175.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -108.41 116.23 31.58 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.321 -0.4 . . . . 74.430000000000007 110.899 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.644 HD12 HG21 ' A' ' 59' ' ' VAL . 65.5 mt -113.12 144.4 42.7 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.699 0.285 . . . . 53.310000000000002 110.747 176.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG2' ' OG ' ' A' ' 22' ' ' SER . 14.7 mmmm -102.4 126.13 49.33 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.779 0.324 . . . . 72.420000000000002 111.314 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m -81.75 121.68 26.71 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 55.039999999999999 111.608 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.502 ' HG3' ' HG2' ' A' ' 18' ' ' GLU . 14.6 tmtt? -54.04 146.4 14.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.758 0.423 . . . . 73.510000000000005 112.024 179.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.58 -51.56 4.59 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.231 -0.509 . . . . 71.299999999999997 113.343 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -85.86 -31.79 22.05 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 120.876 0.37 . . . . 75.430000000000007 111.337 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 61.3 34.53 88.54 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 121.431 -0.414 . . . . 52.5 113.308 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -104.42 152.55 22.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.547 -0.384 . . . . 74.409999999999997 111.099 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.9 ptp -95.11 114.18 25.95 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 121.121 0.486 . . . . 70.200000000000003 112.218 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 28.9 pt -99.01 135.67 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.307 -0.406 . . . . 71.319999999999993 110.654 175.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.0 mp0 -87.05 104.28 16.17 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.933 0.397 . . . . 71.439999999999998 110.637 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 48' ' ' LEU . 91.9 t -94.94 114.23 31.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.954 0.407 . . . . 73.549999999999997 111.423 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.483 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 29.5 t -107.52 131.49 54.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.098 0.475 . . . . 75.109999999999999 111.693 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.9 pt -123.51 147.86 54.02 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 115.947 -0.57 . . . . 61.520000000000003 111.313 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -53.27 151.4 22.63 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.999 2.466 . . . . 73.239999999999995 113.911 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.02 -47.65 61.61 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.664 0.987 . . . . 75.109999999999999 113.664 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.5 m -70.49 -4.12 21.22 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.906 0.706 . . . . 63.329999999999998 112.906 -174.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.25 119.84 77.71 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 120.581 0.229 . . . . 75.329999999999998 110.496 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.18 142.94 44.02 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.942 2.428 . . . . 45.149999999999999 113.693 -176.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.99 128.58 36.18 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.161 -0.472 . . . . 73.310000000000002 111.041 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -79.35 -63.7 1.36 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.407 0.521 . . . . 72.010000000000005 112.407 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 58.64 48.97 10.95 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 112.625 0.602 . . . . 72.510000000000005 112.625 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -75.99 -166.01 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.054 0.454 . . . . 75.230000000000004 112.071 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -91.48 158.74 16.31 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.406 0.521 . . . . 73.340000000000003 112.406 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.6 t80 -60.12 -22.1 62.4 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.891 0.701 . . . . 74.219999999999999 112.891 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.427 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 15.3 m120 -114.54 20.88 15.02 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.883 -0.511 . . . . 62.5 111.308 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.63 117.61 20.7 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.865 0.364 . . . . 53.240000000000002 111.734 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.612 ' NH2' ' HG3' ' A' ' 110' ' ' GLU . 49.9 mtp180 -73.53 111.28 8.52 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.282 -0.417 . . . . 73.450000000000003 111.008 177.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.558 HG12 HD23 ' A' ' 107' ' ' LEU . 34.6 m -117.41 159.32 17.63 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.286 0.565 . . . . 34.100000000000001 112.401 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -135.85 152.55 51.17 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.217 -0.447 . . . . 45.229999999999997 110.979 173.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.5 mt -100.73 138.54 37.64 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.552 0.575 . . . . 61.210000000000001 112.552 -173.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.21 111.54 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.883 -0.598 . . . . 75.140000000000001 110.698 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 20.3 m120 47.04 70.26 2.19 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.958 0.725 . . . . 54.009999999999998 112.958 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.33 151.95 17.91 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.982 2.455 . . . . 63.439999999999998 113.668 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 pt -141.1 139.99 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.22 -0.446 . . . . 73.420000000000002 111.054 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -89.24 102.71 15.37 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.675 0.274 . . . . 73.239999999999995 111.021 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.14 166.57 23.28 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.006 0.431 . . . . 75.340000000000003 111.54 -174.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.8 t -126.52 -4.26 6.61 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.734 0.642 . . . . 53.43 112.734 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -54.11 -21.81 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.945 0.72 . . . . 74.140000000000001 112.945 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.35 -47.85 69.21 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.911 0.386 . . . . 75.299999999999997 111.287 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.2 p -74.26 -10.63 59.79 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.8 0.296 . . . . 55.240000000000002 111.8 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.01 -38.96 72.65 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.862 0.363 . . . . 64.030000000000001 111.314 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.8 p -83.69 -42.94 16.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.241 0.543 . . . . 74.109999999999999 110.79 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -64.91 158.86 24.15 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.437 0.637 . . . . 73.519999999999996 111.847 176.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 92' ' ' GLN . 17.3 tt0 -88.19 21.14 2.9 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.388 0.613 . . . . 61.32 110.075 174.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 73.29 31.24 61.54 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.348 -0.453 . . . . 75.340000000000003 112.495 -172.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.31 -51.66 5.32 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.526 0.565 . . . . 53.240000000000002 112.526 -175.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -114.8 161.58 18.01 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.852 0.358 . . . . 64.109999999999999 111.607 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.2 m -120.01 26.76 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 113.224 0.824 . . . . 73.340000000000003 113.224 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.02 96.25 0.31 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 109.304 -0.628 . . . . 71.340000000000003 109.304 170.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -121.52 159.45 26.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.787 1.032 . . . . 74.349999999999994 113.787 -165.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 34.7 m-85 -115.65 129.11 56.37 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.726 -1.124 . . . . 75.019999999999996 112.793 -174.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 55.7 mt -104.14 108.02 23.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.998 -0.546 . . . . 75.530000000000001 109.728 169.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.483 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 52.0 mtpt -93.48 138.49 31.72 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.501 -0.318 . . . . 73.010000000000005 111.464 -174.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.31 171.86 13.86 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.546 0.572 . . . . 62.439999999999998 112.546 -175.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 -42.55 40.71 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.712 -0.676 . . . . 64.329999999999998 111.252 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -163.95 158.62 19.89 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.164 -0.471 . . . . 74.310000000000002 111.07 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.538 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 42.1 mt -116.57 115.84 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 116.53 -0.305 . . . . 65.5 110.936 -179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.91 179.08 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 120.838 0.351 . . . . 62.020000000000003 111.314 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.558 HD23 HG12 ' A' ' 76' ' ' VAL . 97.9 mt -86.31 142.21 28.68 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.687 0.28 . . . . 74.230000000000004 110.889 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.725 HG22 ' HG2' ' A' ' 110' ' ' GLU . 1.8 m -68.26 120.26 14.13 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.389 . . . . 74.409999999999997 110.975 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 75.0 mt -81.94 34.16 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.218 0.821 . . . . 63.509999999999998 113.218 -171.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.725 ' HG2' HG22 ' A' ' 108' ' ' THR . 6.3 pt-20 . . . . . 0 C--O 1.256 1.442 0 CA-C-O 119.491 -0.29 . . . . 72.450000000000003 111.386 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.5 mtm . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.439 0.162 . . . . 61.299999999999997 111.071 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -128.14 112.75 14.9 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.224 0.535 . . . . 74.540000000000006 110.841 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.424 ' HD3' HH11 ' A' ' 3' ' ' ARG . 37.5 ttp180 -91.6 88.7 6.85 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 73.099999999999994 110.921 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -152.35 164.71 36.91 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.796 -0.638 . . . . 75.219999999999999 111.189 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -168.98 114.69 0.59 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.992 0.367 . . . . 74.510000000000005 111.992 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -150.56 157.27 42.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.185 0.517 . . . . 44.229999999999997 111.632 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -136.51 -26.74 0.41 Allowed Glycine 0 CA--C 1.527 0.834 0 CA-C-N 116.171 -0.468 . . . . 63.310000000000002 112.682 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.9 pt -87.04 170.55 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-O 120.952 0.406 . . . . 75.140000000000001 111.303 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.2 t -90.28 89.21 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.161 0.505 . . . . 71.010000000000005 110.356 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.58 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -79.22 -24.3 43.19 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.324 -0.398 . . . . 74.329999999999998 111.878 -177.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -93.9 -169.17 2.03 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 122.288 -0.258 . . . . 54.310000000000002 111.069 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -109.53 -36.06 6.07 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.612 0.967 . . . . 52.43 113.612 -173.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.7 95.8 0.11 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.324 0.583 . . . . 75.129999999999995 111.849 -177.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.2 p -87.99 12.48 13.24 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.91 -0.587 . . . . 61.329999999999998 111.969 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.1 m -67.88 140.28 56.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.876 0.37 . . . . 73.140000000000001 111.251 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -76.61 27.08 0.13 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 120.794 0.33 . . . . 73.420000000000002 111.848 -175.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.2 -112.5 3.59 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 121.218 -0.515 . . . . 74.409999999999997 112.266 -174.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.35 131.72 51.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.955 0.407 . . . . 64.319999999999993 110.994 176.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.1 mt -92.98 128.35 38.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.608 -0.515 . . . . 65.430000000000007 109.608 174.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 mtpt -101.66 115.71 31.12 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.155 0.503 . . . . 75.230000000000004 110.802 -174.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.441 ' HA ' ' CD2' ' A' ' 48' ' ' LEU . 51.6 t80 -60.17 143.77 51.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.408 -0.814 . . . . 74.040000000000006 112.536 -174.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.542 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 34.3 t -121.3 -66.39 1.05 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.851 0.315 . . . . 62.299999999999997 111.851 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.91 178.01 9.29 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.027 0.441 . . . . 53.399999999999999 112.181 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 67' ' ' LEU . 58.6 tp -94.6 107.46 19.45 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.795 -0.446 . . . . 60.439999999999998 109.795 170.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 25' ' ' ARG . 15.7 tpt180 -65.23 -60.29 3.15 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.277 0.473 . . . . 71.430000000000007 112.277 -173.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -165.86 138.08 4.01 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.161 0.43 . . . . 74.239999999999995 112.161 -175.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 44' ' ' ARG . 39.2 mt-10 -96.51 101.83 13.52 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.284 -0.416 . . . . 71.109999999999999 110.079 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.3 m -69.83 125.92 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.118 0.485 . . . . 72.319999999999993 111.234 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.444 ' HG2' HG12 ' A' ' 41' ' ' ILE . 65.2 mtt85 -104.88 151.97 23.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.433 0.635 . . . . 71.129999999999995 112.373 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -66.81 122.03 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.083 -0.962 . . . . 62.0 112.438 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -99.27 132.82 44.33 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.425 -0.352 . . . . 72.340000000000003 111.048 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -86.11 169.66 12.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.498 0.555 . . . . 72.140000000000001 112.498 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 33' ' ' GLU . 2.4 mp0 -59.12 -35.79 74.06 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.559 -0.746 . . . . 62.509999999999998 111.499 -179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -60.49 -28.46 68.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.104 -0.498 . . . . 64.519999999999996 112.015 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.73 -29.67 7.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 121.177 -0.535 . . . . 33.43 112.368 -174.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.9 m -65.18 143.29 57.95 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.07 0.462 . . . . 64.019999999999996 111.62 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.79 135.48 35.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.057 0.456 . . . . 75.010000000000005 111.763 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.3 t -82.53 158.08 23.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.828 -0.624 . . . . 43.210000000000001 111.506 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -74.43 -8.13 55.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.135 0.493 . . . . 62.439999999999998 110.835 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.09 132.45 43.32 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.865 -0.607 . . . . 53.5 110.893 175.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 ' HG2' ' A' ' 29' ' ' ARG . 52.7 mt -97.99 148.6 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 120.835 0.35 . . . . 74.150000000000006 111.497 -175.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -102.73 -57.44 2.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.75 0.309 . . . . 71.439999999999998 111.068 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.02 151.97 44.5 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.884 0.373 . . . . 74.349999999999994 111.218 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 1.7 ptp180 -116.67 117.14 28.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.231 0.539 . . . . 64.340000000000003 111.27 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.1 m -91.48 123.52 34.96 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 73.140000000000001 112.584 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.502 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.5 m-85 -104.36 148.03 26.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.036 0.534 . . . . 74.239999999999995 110.943 174.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -94.5 120.9 35.44 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.839 0.352 . . . . 75.540000000000006 110.867 174.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 59' ' ' VAL . 63.4 mt -123.55 145.72 48.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.708 0.289 . . . . 71.340000000000003 110.821 177.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HE2' ' HB2' ' A' ' 22' ' ' SER . 0.0 OUTLIER -112.3 141.64 45.78 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.989 0.424 . . . . 65.150000000000006 111.007 174.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p -106.87 155.44 19.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 73.230000000000004 111.822 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -90.94 157.23 17.43 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.91 0.386 . . . . 74.439999999999998 111.318 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.32 -61.46 3.86 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.979 -0.629 . . . . 70.310000000000002 112.031 -176.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -71.3 -24.34 62.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.367 0.267 . . . . 74.140000000000001 110.847 173.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.76 42.51 45.91 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 116.042 -0.526 . . . . 50.530000000000001 114.249 173.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -138.91 168.47 19.75 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.911 0.386 . . . . 75.120000000000005 111.543 -175.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptm -95.39 148.26 22.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.516 0.675 . . . . 74.200000000000003 111.892 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 100' ' ' ILE . 22.5 pt -130.78 150.88 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 115.414 -0.812 . . . . 72.530000000000001 109.759 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.675 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -107.01 105.35 15.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.205 -0.998 . . . . 71.349999999999994 111.32 177.754 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.606 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -94.72 121.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.307 -0.406 . . . . 75.540000000000006 111.303 -177.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' ' HG2' ' A' ' 101' ' ' LYS . 91.3 p -113.63 131.75 56.02 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.418 0.628 . . . . 72.049999999999997 111.503 -178.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.9 pt -122.86 145.4 45.43 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.724 -0.671 . . . . 72.109999999999999 110.302 175.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.82 147.74 17.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.45 2.1 . . . . 61.149999999999999 113.231 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.2 -22.71 63.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.882 0.372 . . . . 61.210000000000001 111.701 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 57.5 p -65.51 -21.38 66.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.305 -0.407 . . . . 70.319999999999993 111.742 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.3 t -85.54 124.5 71.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-N 116.562 -0.29 . . . . 74.430000000000007 110.939 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.92 159.45 7.22 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.161 2.574 . . . . 55.030000000000001 114.617 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 45.2 tp -75.4 128.42 35.33 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.981 -0.554 . . . . 64.030000000000001 111.186 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.92 -64.26 1.2 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.942 0.719 . . . . 74.010000000000005 112.942 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.534 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.7 mt-10 57.02 52.66 8.9 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.843 0.683 . . . . 72.409999999999997 112.843 -178.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.48 173.0 9.45 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.006 -0.434 . . . . 72.200000000000003 111.464 173.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.16 160.57 31.85 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.974 0.416 . . . . 74.439999999999998 111.845 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -71.2 134.46 46.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.941 -0.392 . . . . 73.409999999999997 109.941 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 68.52 12.66 8.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.983 0.513 . . . . 75.349999999999994 112.153 -175.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.49 136.96 54.0 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.88 0.372 . . . . 54.399999999999999 111.576 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -78.27 104.59 8.95 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.439 -0.346 . . . . 74.310000000000002 110.873 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 32.5 m -124.62 154.62 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 121.311 0.577 . . . . 55.350000000000001 111.955 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -130.01 155.69 45.7 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.26 0.552 . . . . 73.219999999999999 110.866 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.2 mt -103.04 139.28 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.529 0.68 . . . . 63.439999999999998 112.421 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 45.6 mm -85.06 106.66 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.581 -0.736 . . . . 65.439999999999998 110.518 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m120 54.6 68.57 2.57 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.335 0.494 . . . . 71.299999999999997 112.335 -176.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.04 130.8 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.724 2.282 . . . . 63.109999999999999 113.452 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 pt -124.91 142.97 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.734 0.302 . . . . 74.219999999999999 111.317 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.66 115.78 26.44 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.6 0.238 . . . . 73.209999999999994 110.914 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.13 165.16 25.66 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.168 0.509 . . . . 71.430000000000007 111.226 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.0 m -150.27 -37.17 0.15 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.953 0.406 . . . . 41.109999999999999 111.265 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.76 6.32 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 112.787 0.662 . . . . 64.329999999999998 112.787 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -48.53 -48.24 38.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.399 0.518 . . . . 74.450000000000003 112.399 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.8 t -59.34 -15.61 17.4 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.618 0.599 . . . . 55.420000000000002 112.618 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -109.22 -21.05 12.74 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.569 0.581 . . . . 72.400000000000006 112.569 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 60.0 p -98.36 -43.1 7.06 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.572 0.582 . . . . 74.409999999999997 112.572 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -78.81 -80.67 0.11 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.765 0.284 . . . . 71.140000000000001 111.765 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -142.89 -49.03 0.33 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.339 0.496 . . . . 70.200000000000003 112.339 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 153.82 -32.22 0.74 Allowed Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.274 -0.965 . . . . 71.219999999999999 113.854 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.59 10.48 9.02 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 122.42 -0.459 . . . . 64.219999999999999 111.718 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -96.79 94.41 7.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.009 -0.542 . . . . 70.409999999999997 111.112 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.48 -33.27 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 112.826 0.676 . . . . 74.349999999999994 112.826 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.34 130.13 45.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.734 0.302 . . . . 64.099999999999994 110.28 175.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.548 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -62.77 108.36 1.16 Allowed 'General case' 0 C--O 1.259 1.562 0 CA-C-O 122.84 1.305 . . . . 74.340000000000003 114.275 -165.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.675 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 80.1 m-85 -84.86 112.81 20.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 113.377 -1.738 . . . . 75.030000000000001 110.418 169.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 57' ' ' ILE . 30.4 mt -90.43 104.34 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.3 0.571 . . . . 62.509999999999998 109.698 177.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.549 ' HG2' ' OG ' ' A' ' 60' ' ' SER . 96.5 mttt -85.21 131.5 34.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 55.409999999999997 111.618 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.93 155.62 45.76 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.177 0.513 . . . . 73.5 112.194 -177.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -68.83 -39.14 80.14 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.753 -0.658 . . . . 65.129999999999995 110.94 176.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -164.31 162.09 22.19 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.029 -0.532 . . . . 74.099999999999994 111.422 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.47 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 39.9 mt -118.75 115.93 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.363 -0.38 . . . . 74.219999999999999 111.077 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -125.01 170.52 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-O 120.743 0.306 . . . . 73.209999999999994 111.682 -178.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.2 mt -72.15 139.09 48.12 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 75.310000000000002 110.921 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -57.79 125.08 21.47 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.605 -0.271 . . . . 50.549999999999997 111.722 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 80.6 mt -58.12 92.47 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.897 0.38 . . . . 45.219999999999999 110.013 174.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 C--O 1.253 1.282 0 CA-C-O 118.363 -0.827 . . . . 74.040000000000006 112.599 -175.616 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.769 0.319 . . . . 65.540000000000006 111.369 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 62.1 mtt -86.7 164.56 16.69 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.123 0.487 . . . . 64.209999999999994 111.331 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.452 ' HA ' ' NE ' ' A' ' 3' ' ' ARG . 6.1 mmp_? -106.5 162.9 13.32 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.022 0.439 . . . . 71.219999999999999 110.271 169.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.458 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.2 mm? -94.8 122.48 37.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.248 0.547 . . . . 71.120000000000005 111.431 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.51 147.45 39.77 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.8 0.667 . . . . 43.409999999999997 112.8 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -85.3 24.61 1.11 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.702 -0.681 . . . . 74.209999999999994 111.662 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.72 95.08 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.557 -0.354 . . . . 51.509999999999998 113.334 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.24 140.68 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.194 0.521 . . . . 55.200000000000003 111.287 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -97.72 114.89 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.261 -0.427 . . . . 75.120000000000005 111.225 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 pp -120.54 173.71 7.01 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.061 0.457 . . . . 64.140000000000001 111.515 178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -111.4 -92.81 0.46 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 122.269 -0.269 . . . . 73.219999999999999 110.644 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? 177.39 98.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.76 -0.83 . . . . 64.409999999999997 108.76 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -58.51 101.35 0.08 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.175 0.806 . . . . 74.310000000000002 113.175 -172.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.1 t -62.11 -17.01 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.874 -0.603 . . . . 44.140000000000001 111.07 172.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.497 ' O ' ' HA3' ' A' ' 52' ' ' GLY . 86.7 m -64.77 -22.29 66.95 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.858 -0.61 . . . . 40.340000000000003 110.928 173.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -123.51 91.71 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.336 -0.393 . . . . 72.200000000000003 112.058 -179.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.73 -178.93 8.31 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 120.667 -0.778 . . . . 54.119999999999997 111.578 168.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' H ' ' HG3' ' A' ' 18' ' ' GLU . 1.3 pp20? -54.34 137.77 41.01 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.11 0.955 . . . . 62.149999999999999 112.161 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 70.0 mt -86.13 170.94 11.73 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.62 -0.718 . . . . 70.230000000000004 111.278 -175.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.721 ' HG2' ' HA ' ' A' ' 73' ' ' ASN . 0.2 OUTLIER -158.49 133.31 8.31 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.002 0.43 . . . . 74.430000000000007 111.894 -179.606 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.465 ' HA ' HD22 ' A' ' 48' ' ' LEU . 36.1 t80 -72.74 143.99 47.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.118 -0.492 . . . . 75.349999999999994 111.566 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 t -125.03 -65.39 1.03 Allowed 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.348 -0.22 . . . . 62.450000000000003 111.413 174.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.16 -173.84 4.06 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.916 0.388 . . . . 64.310000000000002 112.039 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.4 tp -94.94 133.08 39.08 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.806 0.336 . . . . 74.450000000000003 111.134 174.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -88.29 -65.06 1.06 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.837 0.351 . . . . 75.040000000000006 111.836 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -164.32 142.93 7.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.846 0.355 . . . . 70.120000000000005 111.698 -176.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -106.59 98.98 8.59 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.871 -0.418 . . . . 75.319999999999993 109.871 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 28' ' ' VAL . 28.8 m -71.8 92.3 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 121.864 0.84 . . . . 73.120000000000005 111.352 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.652 ' HG2' HG12 ' A' ' 41' ' ' ILE . 71.5 mtt180 -83.34 159.45 21.86 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.583 -0.735 . . . . 74.420000000000002 112.344 -177.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.9 mt -81.01 132.93 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.56 -0.745 . . . . 74.409999999999997 110.911 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -110.57 128.17 55.54 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.837 0.351 . . . . 75.140000000000001 110.536 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -67.79 153.39 43.82 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.638 0.606 . . . . 72.420000000000002 112.638 -173.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.95 -36.94 60.58 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.281 0.563 . . . . 55.25 110.742 172.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -51.05 -42.65 60.66 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.377 -0.829 . . . . 61.149999999999999 111.617 175.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.95 -39.98 1.64 Allowed Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.367 -0.444 . . . . 64.120000000000005 112.55 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.5 m -68.98 148.27 50.38 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.183 0.516 . . . . 73.340000000000003 111.938 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.64 137.73 20.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.081 -0.509 . . . . 64.120000000000005 111.673 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -88.6 166.92 13.8 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.108 0.48 . . . . 72.150000000000006 111.727 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -87.81 -7.62 57.03 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.359 -0.382 . . . . 64.209999999999994 110.95 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.18 135.74 46.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.912 0.387 . . . . 74.230000000000004 110.318 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.652 HG12 ' HG2' ' A' ' 29' ' ' ARG . 39.1 mt -111.48 157.75 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.158 0.504 . . . . 70.209999999999994 111.564 -173.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -97.32 -55.1 2.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.073 0.463 . . . . 65.209999999999994 110.387 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.419 ' H ' HG23 ' A' ' 28' ' ' VAL . 33.3 mt-10 -143.9 155.35 44.05 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.989 -0.55 . . . . 71.25 111.348 175.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.439 ' O ' HG12 ' A' ' 61' ' ' ILE . 39.7 ttm180 -115.99 110.65 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.985 0.421 . . . . 73.340000000000003 110.241 175.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 90.9 m -94.98 125.55 39.72 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.292 0.479 . . . . 73.340000000000003 112.292 -175.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -108.06 158.08 17.71 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.26 0.553 . . . . 73.420000000000002 112.371 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -96.55 107.21 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.539 -0.755 . . . . 75.420000000000002 110.659 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.775 HD12 HG21 ' A' ' 59' ' ' VAL . 56.6 mt -120.43 160.56 22.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.204 0.526 . . . . 65.209999999999994 111.433 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -115.45 145.6 42.43 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.235 -0.438 . . . . 75.129999999999995 110.871 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.1 m -128.73 123.66 33.6 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 122.216 -0.303 . . . . 45.240000000000002 111.759 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -64.36 -31.72 73.04 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.618 0.599 . . . . 71.109999999999999 112.618 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.497 ' HA3' ' O ' ' A' ' 15' ' ' THR . . . -50.32 -75.67 0.2 Allowed Glycine 0 CA--C 1.525 0.661 0 C-N-CA 121.09 -0.576 . . . . 72.549999999999997 113.406 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -86.74 7.42 26.86 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 122.455 -0.438 . . . . 71.439999999999998 111.63 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 55.43 36.78 64.29 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 114.486 0.554 . . . . 74.140000000000001 114.486 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -133.28 -179.72 5.68 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.071 0.462 . . . . 65.349999999999994 111.407 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.87 149.19 22.75 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.115 0.483 . . . . 74.340000000000003 111.134 176.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.573 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 31.2 pt -124.46 136.3 61.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 72.349999999999994 110.668 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 18.1 mm-40 -94.58 104.41 16.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.428 -0.509 . . . . 62.509999999999998 110.461 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.775 HG21 HD12 ' A' ' 48' ' ' LEU . 95.6 t -95.01 117.05 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.937 0.347 . . . . 74.239999999999995 111.937 -174.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.7 m -106.97 116.55 32.11 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.381 -0.372 . . . . 53.030000000000001 111.191 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HG13 ' A' ' 105' ' ' ILE . 21.8 pt -110.16 148.9 39.29 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.186 -0.461 . . . . 73.329999999999998 111.126 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.34 153.85 56.98 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.517 2.145 . . . . 51.520000000000003 113.195 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.42 -19.19 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.55 0.574 . . . . 34.409999999999997 112.55 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.8 m -68.35 -9.33 47.3 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.686 0.279 . . . . 70.540000000000006 111.689 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.456 HG11 HD12 ' A' ' 61' ' ' ILE . 45.5 t -92.8 132.14 31.96 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 116.481 -0.327 . . . . 64.430000000000007 111.501 179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -177.09 1.9 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.594 2.196 . . . . 73.420000000000002 113.778 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' A' ' 69' ' ' GLU . 30.9 tp -82.67 141.68 32.27 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.088 -0.506 . . . . 75.109999999999999 111.806 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.405 ' HE2' HG12 ' A' ' 65' ' ' VAL . 4.7 mptp? -102.4 -68.2 0.84 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.858 0.361 . . . . 75.239999999999995 111.643 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 38.1 mm-40 50.75 56.12 8.48 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.668 0.618 . . . . 75.420000000000002 112.668 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -75.73 171.49 14.27 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.0 0.429 . . . . 71.129999999999995 111.189 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -71.52 151.46 43.87 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 75.099999999999994 112.305 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.409 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 82.0 t80 -56.98 121.85 10.91 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.726 -0.67 . . . . 65.019999999999996 110.798 174.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.721 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 6.6 m-20 72.09 30.39 2.16 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.678 0.622 . . . . 74.120000000000005 112.678 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -84.25 145.1 28.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.535 -0.302 . . . . 62.109999999999999 110.512 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -74.46 114.99 13.48 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.165 -0.335 . . . . 72.129999999999995 111.458 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.512 HG12 HD23 ' A' ' 107' ' ' LEU . 31.0 m -125.5 147.24 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 120.671 0.272 . . . . 62.210000000000001 111.599 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.38 149.59 50.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.876 0.369 . . . . 71.0 110.789 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.415 ' CD2' HG12 ' A' ' 105' ' ' ILE . 98.1 mt -102.16 137.18 40.76 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.591 0.589 . . . . 53.450000000000003 112.591 -172.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.8 mm -83.68 106.67 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.909 -0.587 . . . . 71.349999999999994 110.515 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 62.09 64.35 1.86 Allowed Pre-proline 0 N--CA 1.476 0.862 0 CA-C-N 116.268 -0.424 . . . . 72.400000000000006 112.138 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.98 128.86 6.7 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.62 2.214 . . . . 62.240000000000002 112.979 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.6 pt -135.06 127.48 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.962 0.41 . . . . 75.310000000000002 111.565 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.12 99.69 3.44 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.875 -0.417 . . . . 75.019999999999996 109.875 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.36 159.65 32.76 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.298 0.57 . . . . 73.109999999999999 112.24 -171.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.1 m -136.17 -10.72 1.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.907 -0.588 . . . . 70.519999999999996 111.92 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.7 m -116.06 2.77 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 N-CA-C 112.621 0.6 . . . . 71.430000000000007 112.621 -174.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.442 ' O ' HG22 ' A' ' 90' ' ' THR . . . -63.55 78.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.103 0.478 . . . . 71.200000000000003 111.985 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.7 p -59.46 -25.9 64.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.301 -0.409 . . . . 44.229999999999997 111.936 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.77 58.88 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.505 0.557 . . . . 74.319999999999993 112.505 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 95' ' ' ASP . 11.5 t -93.73 -40.62 10.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 120.903 0.382 . . . . 74.319999999999993 111.775 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -65.81 -31.48 72.47 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.794 0.331 . . . . 64.239999999999995 111.644 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -62.5 -25.97 68.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.007 0.432 . . . . 65.239999999999995 110.759 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -97.72 13.85 63.55 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 116.091 -0.504 . . . . 50.340000000000003 112.929 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 61.45 25.45 15.39 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.41 0.522 . . . . 43.43 112.41 179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.492 ' HB3' ' OG1' ' A' ' 90' ' ' THR . 9.9 t70 -97.81 114.28 26.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.015 0.436 . . . . 65.140000000000001 110.172 178.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 96' ' ' VAL . 16.3 t -104.88 -6.73 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.058 0.762 . . . . 73.230000000000004 113.058 -169.255 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -62.44 121.98 14.59 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.019 0.437 . . . . 53.009999999999998 110.632 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.573 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -59.75 123.3 16.51 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 113.998 1.11 . . . . 73.340000000000003 113.998 -171.506 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 70.6 m-85 -97.2 117.37 31.26 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.552 -1.204 . . . . 72.0 111.026 175.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 28.6 mt -95.92 105.47 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 121.18 0.514 . . . . 73.340000000000003 110.194 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -78.66 136.16 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.171 -0.468 . . . . 52.340000000000003 111.306 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.38 155.53 47.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.387 -0.37 . . . . 74.439999999999998 110.657 179.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -80.82 -23.64 39.06 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.55 0.214 . . . . 71.239999999999995 111.333 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -169.89 159.54 7.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.276 0.56 . . . . 63.0 111.741 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.478 HG13 HG21 ' A' ' 61' ' ' ILE . 37.0 mt -119.57 109.07 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.844 -0.616 . . . . 71.430000000000007 111.223 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.0 m -113.16 178.63 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 120.834 0.35 . . . . 72.349999999999994 111.084 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG12 ' A' ' 76' ' ' VAL . 96.1 mt -88.04 151.33 22.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.19 0.519 . . . . 75.209999999999994 111.331 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.548 HG22 ' HG ' ' A' ' 109' ' ' LEU . 16.8 m -87.03 134.9 33.45 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 110.138 -0.319 . . . . 73.530000000000001 110.138 176.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.548 ' HG ' HG22 ' A' ' 108' ' ' THR . 81.9 mt 65.75 20.59 11.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.274 0.472 . . . . 51.350000000000001 112.274 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.494 ' HB3' ' HB2' ' A' ' 107' ' ' LEU . 7.0 pt-20 . . . . . 0 C--O 1.251 1.173 0 N-CA-C 112.315 0.487 . . . . 74.519999999999996 112.315 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.7 ttm . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.668 0.27 . . . . 73.310000000000002 111.244 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 6' ' ' ASN . 64.0 mtt -131.5 136.22 47.72 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.619 0.247 . . . . 62.009999999999998 110.735 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -59.75 -14.56 14.99 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.019 0.438 . . . . 74.109999999999999 111.133 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 4' ' ' LEU . 2.9 mm? -69.73 114.89 8.36 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.073 -0.512 . . . . 70.239999999999995 110.541 174.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 4' ' ' LEU . . . 74.96 -42.04 0.48 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.902 0.705 . . . . 73.439999999999998 112.902 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 2' ' ' MET . 14.1 m120 -75.86 90.67 2.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.012 0.434 . . . . 64.439999999999998 111.706 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -129.47 -55.15 0.1 Allowed Glycine 0 CA--C 1.527 0.784 0 C-N-CA 121.478 -0.391 . . . . 63.509999999999998 112.76 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.7 pt -59.96 149.15 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 120.836 0.35 . . . . 74.349999999999994 111.925 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.8 t -70.1 130.43 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 120.824 0.345 . . . . 61.539999999999999 111.346 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.36 178.56 7.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.154 0.502 . . . . 74.430000000000007 112.142 -176.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -66.22 171.41 4.75 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.898 -0.592 . . . . 54.520000000000003 112.596 -177.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.444 ' NZ ' ' HB2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -174.45 142.69 0.78 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.169 -0.468 . . . . 73.540000000000006 110.943 174.827 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -66.9 105.15 1.53 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.957 0.408 . . . . 61.109999999999999 111.72 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.6 p -74.82 82.24 2.13 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.312 0.577 . . . . 74.299999999999997 111.101 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -98.67 131.56 44.74 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.083 -0.508 . . . . 62.109999999999999 111.487 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HB3' HD21 ' A' ' 19' ' ' LEU . 98.5 m-85 -70.55 -50.14 40.57 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.279 -0.419 . . . . 73.219999999999999 111.752 -177.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.71 -159.14 32.89 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.002 -0.545 . . . . 70.310000000000002 112.075 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.617 ' HG2' ' HG2' ' A' ' 51' ' ' LYS . 10.4 pt-20 -66.84 109.03 2.75 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.291 0.567 . . . . 72.010000000000005 110.809 175.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.451 ' HB2' HG23 ' A' ' 76' ' ' VAL . 99.1 mt -73.72 127.43 32.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 54.539999999999999 110.57 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -101.85 105.64 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.189 0.519 . . . . 74.200000000000003 111.298 -175.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -58.6 135.49 57.37 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.409 -0.814 . . . . 73.349999999999994 112.651 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.6 m -113.17 -62.47 1.58 Allowed 'General case' 0 N--CA 1.471 0.615 0 O-C-N 122.039 -0.413 . . . . 73.25 111.529 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.449 ' H ' ' HB2' ' A' ' 47' ' ' ASP . . . -153.9 163.17 40.49 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.299 0.571 . . . . 62.420000000000002 112.104 -178.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 51.4 tp -74.81 111.8 10.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.319 -0.622 . . . . 50.409999999999997 109.319 171.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 13.4 tpt180 -63.54 -50.03 71.13 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.666 -0.243 . . . . 71.310000000000002 111.651 -172.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -176.74 147.58 0.63 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.531 0.567 . . . . 74.349999999999994 112.531 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.467 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 43.6 mt-10 -105.93 102.38 11.82 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.972 -0.558 . . . . 73.319999999999993 110.419 171.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -81.54 113.12 20.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 121.495 0.664 . . . . 63.310000000000002 110.267 174.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -101.1 157.1 17.02 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.138 -0.483 . . . . 64.239999999999995 110.681 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.2 mt -67.42 108.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.238 0.542 . . . . 53.450000000000003 111.741 -175.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -88.94 119.48 29.5 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.364 -0.38 . . . . 71.409999999999997 110.925 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.67 158.32 32.49 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.199 0.444 . . . . 74.200000000000003 112.199 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.37 -17.31 28.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.374 -0.375 . . . . 72.239999999999995 111.558 174.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.34 -4.79 35.53 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.327 -0.397 . . . . 64.109999999999999 111.851 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -28.66 10.3 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.318 -0.467 . . . . 22.23 113.181 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.2 m -81.98 153.64 26.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.057 0.456 . . . . 71.109999999999999 111.901 -178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.17 133.79 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.133 0.492 . . . . 71.140000000000001 111.404 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -84.03 167.33 16.96 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.334 0.588 . . . . 74.040000000000006 112.225 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.65 -25.07 64.63 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.758 -0.655 . . . . 64.209999999999994 110.72 176.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -76.4 131.33 39.05 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.848 -0.614 . . . . 61.509999999999998 111.623 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -94.72 149.0 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.417 -0.356 . . . . 61.200000000000003 110.765 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -92.92 -57.36 2.67 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.65 0.262 . . . . 75.310000000000002 111.23 -177.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' OE1' ' HE3' ' A' ' 101' ' ' LYS . 14.7 pt-20 -163.82 168.66 19.3 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.748 0.309 . . . . 72.400000000000006 111.22 176.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.527 ' HD3' HD13 ' A' ' 67' ' ' LEU . 45.6 mtt180 -128.18 125.63 39.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.565 0.579 . . . . 75.439999999999998 112.565 -174.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 28.9 m -100.05 133.29 44.66 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 116.035 -0.529 . . . . 71.219999999999999 112.091 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.59 151.6 35.88 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.076 0.55 . . . . 72.129999999999995 112.39 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.498 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 31.8 m-20 -91.24 107.62 19.33 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.048 -0.524 . . . . 71.430000000000007 111.276 171.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.427 HD12 HG21 ' A' ' 59' ' ' VAL . 77.0 mt -116.08 120.72 39.98 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.919 0.39 . . . . 73.400000000000006 110.724 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.726 ' NZ ' ' SD ' ' A' ' 56' ' ' MET . 71.7 mmtt -92.7 148.34 22.13 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.41 -0.359 . . . . 52.530000000000001 110.853 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.8 m -72.34 158.68 35.35 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.718 0.294 . . . . 51.420000000000002 111.568 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.617 ' HG2' ' HG2' ' A' ' 18' ' ' GLU . 1.9 tmtp? -58.0 -63.67 1.17 Allowed 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 116.569 -0.287 . . . . 74.219999999999999 111.578 -177.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.95 47.11 0.54 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.102 -0.57 . . . . 71.530000000000001 113.195 -177.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -110.2 -32.2 7.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.959 0.409 . . . . 63.119999999999997 111.117 178.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.97 27.96 8.02 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 121.223 -0.513 . . . . 64.25 113.453 -178.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -139.9 178.11 7.49 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.658 -0.319 . . . . 75.209999999999994 110.72 178.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.726 ' SD ' ' NZ ' ' A' ' 49' ' ' LYS . 21.4 ptt? -145.7 168.8 19.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.926 0.393 . . . . 44.299999999999997 111.664 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.56 134.52 46.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.009 -0.541 . . . . 73.150000000000006 110.749 176.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.37 105.37 17.45 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.905 0.383 . . . . 73.219999999999999 110.506 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 67.5 t -97.33 120.17 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 120.944 0.402 . . . . 71.109999999999999 111.927 -173.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 15.4 t -109.47 115.1 29.3 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.911 0.386 . . . . 42.149999999999999 111.61 -178.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -103.6 151.57 38.74 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 116.512 -0.313 . . . . 64.129999999999995 111.676 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.47 148.6 90.25 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.71 2.273 . . . . 73.109999999999999 113.303 -178.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -15.07 63.45 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.725 0.639 . . . . 61.409999999999997 112.725 -177.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 43.9 t -64.02 -20.58 66.01 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.981 0.42 . . . . 73.200000000000003 111.114 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.0 t -92.84 122.69 63.37 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.188 -0.46 . . . . 74.420000000000002 111.207 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.09 151.45 16.59 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.97 2.447 . . . . 71.540000000000006 113.637 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.527 HD13 ' HD3' ' A' ' 44' ' ' ARG . 28.7 tp -69.73 141.35 53.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.277 -0.419 . . . . 71.25 111.576 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -81.4 -57.63 3.4 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.028 0.751 . . . . 73.310000000000002 113.028 -170.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 59.5 41.86 18.51 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.263 0.468 . . . . 71.340000000000003 112.263 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.54 168.22 7.74 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.209 0.528 . . . . 54.420000000000002 111.651 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.89 153.35 43.39 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.495 -0.32 . . . . 72.019999999999996 110.911 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 59.0 t80 -62.64 119.05 8.49 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.795 0.331 . . . . 72.340000000000003 111.335 -178.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.44 HD22 ' N ' ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.54 19.8 5.0 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.246 0.618 . . . . 72.219999999999999 112.1 -178.159 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.77 141.21 58.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.088 0.47 . . . . 71.150000000000006 110.891 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 75' ' ' ARG . 29.4 mtp180 -72.94 112.65 9.17 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.932 -0.577 . . . . 74.430000000000007 111.128 -177.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.53 HG12 HD23 ' A' ' 107' ' ' LEU . 32.4 m -126.45 161.47 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.201 0.524 . . . . 71.340000000000003 111.891 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -143.02 154.26 43.81 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.014 0.435 . . . . 71.109999999999999 110.843 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.7 mt -95.3 142.66 27.44 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.527 0.565 . . . . 74.510000000000005 112.527 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.61 -77.58 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 CA-C-N 116.067 -0.515 . . . . 62.539999999999999 110.906 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -130.78 92.23 34.87 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.744 0.306 . . . . 72.409999999999997 111.173 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -82.68 156.94 16.11 Favored 'Trans proline' 0 CA--C 1.546 1.095 0 C-N-CA 123.246 2.631 . . . . 23.440000000000001 114.25 177.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 pt -145.46 132.87 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.332 0.653 . . . . 74.519999999999996 110.558 173.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.04 116.0 15.29 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.12 -0.363 . . . . 53.439999999999998 110.857 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.432 ' OD2' HG23 ' A' ' 85' ' ' THR . 18.7 t70 -107.69 -76.98 0.6 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.902 0.382 . . . . 73.519999999999996 111.733 -174.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.432 HG23 ' OD2' ' A' ' 84' ' ' ASP . 30.1 p -103.34 85.88 2.56 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.491 0.662 . . . . 71.310000000000002 110.922 -178.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 86' ' ' VAL . 8.0 p -74.33 98.38 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 121.971 0.891 . . . . 53.240000000000002 110.091 176.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 90' ' ' THR . . . -53.57 -32.58 51.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.409 -0.814 . . . . 72.120000000000005 113.066 -171.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.9 p -56.24 -29.12 60.61 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.291 0.478 . . . . 71.439999999999998 112.291 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.58 8.81 35.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.937 0.717 . . . . 51.049999999999997 112.937 -176.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 87' ' ' ALA . 7.4 t -114.4 2.13 14.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 121.926 -0.484 . . . . 71.019999999999996 112.203 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -114.19 -173.66 2.33 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.061 0.457 . . . . 64.010000000000005 112.075 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -93.64 28.73 2.22 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.47 0.545 . . . . 74.019999999999996 112.47 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 128.12 -21.28 5.53 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 120.813 -0.708 . . . . 43.329999999999998 113.911 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.98 111.95 3.09 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.868 0.692 . . . . 75.209999999999994 112.868 -177.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -80.88 108.77 14.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.317 -0.402 . . . . 63.310000000000002 110.507 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -135.64 -179.31 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 121.185 0.517 . . . . 63.409999999999997 112.102 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -59.18 155.53 13.93 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.66 0.615 . . . . 64.040000000000006 112.66 178.105 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.426 ' CH2' HD11 ' A' ' 100' ' ' ILE . 1.3 p-90 -123.14 158.87 29.77 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.274 0.559 . . . . 71.400000000000006 112.33 -172.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -111.05 126.09 54.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 121.634 0.73 . . . . 74.420000000000002 112.737 -172.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 63.6 mt -116.51 125.1 73.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.557 -0.747 . . . . 75.409999999999997 110.937 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HE3' ' OE1' ' A' ' 43' ' ' GLU . 56.6 mtpt -90.39 143.14 27.04 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.723 -0.473 . . . . 71.129999999999995 109.723 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.95 164.0 29.38 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.054 0.761 . . . . 70.030000000000001 113.054 -174.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.3 -58.75 5.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.235 -0.893 . . . . 75.329999999999998 110.914 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -164.37 163.25 22.45 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.205 -0.452 . . . . 75.209999999999994 111.492 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 50.2 mt -120.02 124.76 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.083 -0.508 . . . . 74.200000000000003 111.189 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.2 m -123.34 179.29 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 122.282 -0.261 . . . . 74.329999999999998 111.291 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 76' ' ' VAL . 93.0 mt -81.04 151.76 28.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.856 0.36 . . . . 75.140000000000001 111.311 178.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 24.7 m -72.96 129.5 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.898 0.38 . . . . 73.519999999999996 111.955 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.57 -54.23 11.16 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.098 0.475 . . . . 73.439999999999998 111.732 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 . . . . . 0 C--O 1.253 1.269 0 CA-C-N 115.996 -0.547 . . . . 65.439999999999998 112.203 -178.987 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 mmt . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.778 0.323 . . . . 71.329999999999998 111.455 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 62.2 mtt 59.31 67.78 0.87 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.403 0.621 . . . . 63.310000000000002 111.846 -178.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -84.2 106.74 16.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.85 -0.614 . . . . 70.140000000000001 110.637 175.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.91 137.37 57.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.941 0.4 . . . . 42.409999999999997 111.562 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.42 123.62 26.27 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.112 0.482 . . . . 71.109999999999999 111.923 -179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -113.71 -176.36 2.88 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.981 -0.554 . . . . 62.109999999999999 111.227 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 159.69 -65.57 0.28 Allowed Glycine 0 CA--C 1.529 0.908 0 C-N-CA 120.889 -0.672 . . . . 40.530000000000001 113.116 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.8 pt -118.53 174.88 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 O-C-N 122.564 -0.374 . . . . 74.019999999999996 111.573 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -57.08 112.4 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-O 121.384 0.612 . . . . 61.340000000000003 111.675 176.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.412 HD12 ' N ' ' A' ' 11' ' ' ASP . 4.0 pp -60.75 -22.42 64.01 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.417 0.525 . . . . 72.409999999999997 112.417 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.412 ' N ' HD12 ' A' ' 10' ' ' LEU . 2.6 m-20 -59.23 -27.84 66.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.847 0.356 . . . . 62.329999999999998 111.755 176.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -100.45 -14.96 18.08 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.018 0.437 . . . . 74.129999999999995 111.242 176.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -72.06 -38.77 69.4 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.451 -0.34 . . . . 70.400000000000006 111.121 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -83.08 135.1 34.95 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 121.099 0.476 . . . . 60.350000000000001 111.565 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.3 p -125.08 -168.81 1.88 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.169 0.509 . . . . 75.030000000000001 111.895 -177.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.434 ' HB3' HD21 ' A' ' 19' ' ' LEU . 71.1 m-85 -88.83 95.88 10.47 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 122.048 -0.408 . . . . 73.129999999999995 112.097 -176.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.413 ' H ' ' HA3' ' A' ' 52' ' ' GLY . . . -73.0 -99.69 0.08 OUTLIER Glycine 0 CA--C 1.531 1.047 0 C-N-CA 121.108 -0.568 . . . . 70.140000000000001 112.504 174.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 51' ' ' LYS . 45.2 mt-10 -76.54 120.89 22.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.488 -0.419 . . . . 72.439999999999998 111.741 174.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' A' ' 16' ' ' PHE . 95.5 mt -113.6 114.9 27.1 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.588 -0.523 . . . . 75.439999999999998 109.588 171.139 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -125.71 129.37 49.4 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.49 0.662 . . . . 61.140000000000001 112.665 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -67.66 138.12 56.09 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.313 -0.858 . . . . 73.409999999999997 112.348 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.46 ' OG ' ' HD3' ' A' ' 49' ' ' LYS . 59.1 m -113.47 -64.7 1.27 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 111.893 0.331 . . . . 53.25 111.893 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.43 168.97 24.0 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.293 0.568 . . . . 74.310000000000002 112.393 -177.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.41 HD21 ' HG3' ' A' ' 27' ' ' GLU . 64.8 tp -81.41 112.09 18.36 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.57 -0.741 . . . . 70.129999999999995 110.278 172.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -68.51 -52.64 29.94 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.81 0.338 . . . . 61.350000000000001 111.34 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -175.56 134.84 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.058 0.392 . . . . 64.230000000000004 112.058 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.532 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.3 mt-10 -93.16 98.41 11.28 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.895 -0.409 . . . . 73.450000000000003 109.895 169.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.5 m -70.41 128.08 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.968 0.414 . . . . 72.040000000000006 110.752 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 41' ' ' ILE . 62.6 mtt180 -100.96 168.6 9.51 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.564 0.697 . . . . 73.349999999999994 112.804 -175.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.92 112.43 10.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.312 -0.858 . . . . 71.400000000000006 111.116 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.5 tt0 -84.96 115.0 22.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.861 0.362 . . . . 73.329999999999998 111.081 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -55.76 144.9 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.195 -0.457 . . . . 52.420000000000002 111.217 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -55.49 -24.01 29.09 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.365 0.505 . . . . 60.119999999999997 112.365 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.76 -37.9 74.45 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.007 0.432 . . . . 74.400000000000006 111.552 173.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.52 -17.24 5.57 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.35 -0.453 . . . . 53.310000000000002 113.098 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.4 m -94.77 148.83 21.88 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.31 -0.523 . . . . 74.329999999999998 111.754 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.581 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 34.1 t -82.38 143.62 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 120.949 0.404 . . . . 71.420000000000002 111.794 -177.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -94.02 178.84 5.52 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.037 0.446 . . . . 52.140000000000001 111.771 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -85.07 -21.42 29.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.3 -0.409 . . . . 64.450000000000003 111.29 177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -69.74 136.63 51.18 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.474 -0.33 . . . . 74.349999999999994 110.805 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 29' ' ' ARG . 50.7 mt -90.39 144.73 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.339 0.59 . . . . 74.230000000000004 111.858 -175.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.513 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 28.9 tptp -97.9 -59.18 1.82 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.626 -0.715 . . . . 42.43 110.904 179.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.513 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.9 mt-10 -145.92 170.21 17.05 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.993 0.425 . . . . 75.420000000000002 111.089 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 54.5 mtt180 -128.1 119.05 24.55 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.778 0.431 . . . . 53.210000000000001 111.367 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 62.9 m -100.99 131.42 46.88 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.27 0.47 . . . . 63.210000000000001 112.27 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.482 ' OH ' HD12 ' A' ' 67' ' ' LEU . 39.6 m-85 -125.08 156.33 38.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.719 0.407 . . . . 72.319999999999993 111.38 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -99.97 123.04 43.78 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.693 -0.23 . . . . 71.340000000000003 111.413 173.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.499 HD12 HG21 ' A' ' 59' ' ' VAL . 51.6 mt -119.72 130.21 54.89 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.805 0.336 . . . . 75.430000000000007 111.498 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.507 ' HE3' ' SD ' ' A' ' 56' ' ' MET . 14.3 mptt -80.83 115.54 20.37 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.624 0.249 . . . . 75.349999999999994 110.834 173.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.6 t -101.26 108.75 20.47 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.679 0.276 . . . . 74.329999999999998 111.187 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 18' ' ' GLU . 17.5 tppt? -69.38 -38.24 77.94 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.877 0.37 . . . . 64.239999999999995 111.485 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.413 ' HA3' ' H ' ' A' ' 17' ' ' GLY . . . -66.69 -39.32 93.67 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 121.037 -0.601 . . . . 72.439999999999998 113.074 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.417 ' HG2' ' HZ2' ' A' ' 98' ' ' TRP . 6.2 tp-100 -88.12 -21.63 24.56 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.981 0.42 . . . . 71.230000000000004 111.539 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.91 26.84 73.87 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 121.421 -0.419 . . . . 63.539999999999999 112.853 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -135.56 158.38 44.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.982 0.42 . . . . 72.510000000000005 111.708 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.507 ' SD ' ' HE3' ' A' ' 49' ' ' LYS . 63.8 mtm -93.56 107.73 19.55 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.638 -0.505 . . . . 71.409999999999997 109.638 168.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.457 HD12 HD12 ' A' ' 100' ' ' ILE . 24.2 pt -94.71 134.83 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.465 0.174 . . . . 64.129999999999995 111.393 -174.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -90.6 104.94 17.46 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 75.400000000000006 111.204 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 91.9 t -96.59 128.37 47.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.91 -0.587 . . . . 75.120000000000005 111.31 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.624 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 48.9 m -123.08 137.82 54.83 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 65.019999999999996 111.891 -176.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 pt -124.42 147.81 56.43 Favored Pre-proline 0 N--CA 1.472 0.671 0 CA-C-N 116.213 -0.449 . . . . 63.340000000000003 110.798 177.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.36 150.54 86.82 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.298 1.999 . . . . 72.420000000000002 112.482 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.13 -32.94 37.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.763 0.653 . . . . 64.150000000000006 112.763 -176.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.8 m -53.46 -32.81 51.69 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.233 0.457 . . . . 71.420000000000002 112.233 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -82.08 116.15 61.73 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.616 -0.265 . . . . 43.520000000000003 110.748 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -49.74 141.43 27.67 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.163 2.575 . . . . 73.409999999999997 113.755 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.57 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 31.6 tp -52.63 138.0 29.44 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.302 -0.408 . . . . 50.240000000000002 110.844 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.523 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 24.7 mmmt -79.97 -57.55 3.59 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.621 0.6 . . . . 74.239999999999995 112.621 -170.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.57 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 39.2 mt-10 57.86 39.57 26.74 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 112.592 0.59 . . . . 64.129999999999995 112.592 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -70.66 172.69 8.23 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.168 0.508 . . . . 74.310000000000002 112.056 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.577 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 5.8 m-20 -70.17 157.72 37.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.381 0.61 . . . . 65.219999999999999 112.084 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.425 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 7.6 t80 -70.66 117.38 12.11 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.793 -0.639 . . . . 72.349999999999994 110.902 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 46.9 m-80 74.92 21.82 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.592 0.757 . . . . 64.430000000000007 112.069 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.577 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -74.95 141.63 44.04 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.963 0.357 . . . . 51.399999999999999 111.963 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 70.7 mtm180 -67.45 116.16 7.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.599 -0.273 . . . . 71.010000000000005 110.717 178.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.52 140.03 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-O 121.042 0.449 . . . . 75.409999999999997 112.171 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.431 ' HG3' HG23 ' A' ' 106' ' ' VAL . 8.1 pt-20 -124.53 157.16 35.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.232 0.539 . . . . 64.150000000000006 111.025 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.95 132.13 45.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.262 -0.427 . . . . 72.0 111.777 -176.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.435 HG22 ' OD1' ' A' ' 80' ' ' ASN . 50.0 mm -63.62 -72.61 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 116.28 -0.418 . . . . 64.540000000000006 111.364 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.488 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 23.3 m120 -125.32 89.96 51.64 Favored Pre-proline 0 N--CA 1.476 0.858 0 CA-C-O 120.573 0.225 . . . . 52.229999999999997 110.452 174.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.87 147.7 15.24 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.202 2.601 . . . . 64.219999999999999 114.352 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 101' ' ' LYS . 38.4 pt -140.04 149.14 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.967 0.413 . . . . 72.439999999999998 110.78 172.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.14 116.51 28.87 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.916 0.388 . . . . 70.25 110.816 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.536 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . 17.9 t70 -83.67 158.38 21.86 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.479 0.657 . . . . 74.120000000000005 112.442 -174.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.4 m -139.26 -8.72 1.3 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.854 -0.612 . . . . 70.409999999999997 111.462 176.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.458 HG22 HG22 ' A' ' 90' ' ' THR . 9.8 p -86.6 -10.71 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.938 -0.476 . . . . 53.340000000000003 111.382 -176.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.75 -13.53 10.58 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.476 0.547 . . . . 62.520000000000003 112.476 178.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.0 t -109.91 -9.93 14.76 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.024 0.44 . . . . 55.119999999999997 111.535 174.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -91.62 -57.2 2.84 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.336 -0.393 . . . . 74.209999999999994 111.816 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.458 HG22 HG22 ' A' ' 86' ' ' VAL . 9.8 t -85.93 -23.03 27.14 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.994 0.426 . . . . 71.340000000000003 111.274 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -113.67 104.77 12.57 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.248 -0.433 . . . . 73.340000000000003 109.859 174.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -79.55 107.9 12.67 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 73.420000000000002 111.975 -172.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.37 12.43 67.43 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 121.459 -0.4 . . . . 64.120000000000005 113.642 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.15 -31.89 23.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 122.385 -0.479 . . . . 72.400000000000006 112.21 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.497 ' HA ' ' HE1' ' A' ' 99' ' ' TYR . 33.5 t70 -68.69 141.92 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.891 0.377 . . . . 61.119999999999997 111.751 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.62 -78.62 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 120.888 0.375 . . . . 65.430000000000007 110.751 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.95 -61.22 1.61 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.584 -0.28 . . . . 70.140000000000001 110.812 174.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.417 ' HZ2' ' HG2' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -172.37 143.02 1.37 Allowed 'General case' 0 C--O 1.247 0.965 0 CA-C-O 122.545 1.164 . . . . 72.310000000000002 113.982 170.388 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.497 ' HE1' ' HA ' ' A' ' 95' ' ' ASP . 53.5 m-85 -110.39 122.27 47.28 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.25 -1.341 . . . . 75.340000000000003 111.094 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 34.6 mt -105.27 104.63 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.085 0.469 . . . . 73.439999999999998 110.46 177.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.624 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 50.3 mtpt -87.42 130.26 34.73 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.997 -0.44 . . . . 71.329999999999998 111.17 -176.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.12 157.93 31.81 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.651 0.611 . . . . 50.549999999999997 112.651 -173.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 28.9 t70 -66.95 -38.37 86.01 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.469 -0.787 . . . . 64.420000000000002 111.294 175.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -169.8 161.08 8.98 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.168 -0.469 . . . . 72.540000000000006 110.951 176.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.523 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 42.3 mt -119.28 120.98 65.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.148 -0.478 . . . . 63.240000000000002 110.883 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.431 HG23 ' HG3' ' A' ' 77' ' ' GLU . 27.8 m -120.42 -179.65 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 122.218 -0.301 . . . . 44.43 111.105 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.5 128.47 35.23 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.944 0.402 . . . . 63.329999999999998 111.901 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.492 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 26.4 m -64.48 105.93 1.04 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.429 0.633 . . . . 65.340000000000003 111.234 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.733 HD23 ' H ' ' A' ' 109' ' ' LEU . 1.8 pt? -74.29 -8.45 56.29 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.514 -0.766 . . . . 73.230000000000004 111.91 177.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 . . . . . 0 C--O 1.257 1.479 0 CA-C-O 119.033 -0.508 . . . . 71.530000000000001 111.635 -179.704 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 112.008 0.373 . . . . 72.340000000000003 112.008 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.471 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.3 OUTLIER -129.83 124.7 33.94 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.845 0.355 . . . . 74.219999999999999 110.926 177.095 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -75.31 81.33 2.4 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.222 0.534 . . . . 74.120000000000005 111.895 -175.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -105.79 -69.39 0.82 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.099 -0.501 . . . . 72.129999999999995 110.792 174.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -111.1 130.92 55.47 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.237 -0.438 . . . . 74.329999999999998 111.076 176.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -66.98 123.34 19.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.003 0.43 . . . . 75.329999999999998 111.873 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -177.41 131.03 1.72 Allowed Glycine 0 CA--C 1.524 0.645 0 C-N-CA 121.138 -0.553 . . . . 73.120000000000005 112.584 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 pt -130.54 153.44 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 121.012 0.434 . . . . 73.409999999999997 111.643 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.75 118.91 21.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.98 0.419 . . . . 74.409999999999997 111.234 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -84.61 166.78 16.84 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.415 0.626 . . . . 73.530000000000001 112.315 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.433 ' OD2' ' HB ' ' A' ' 14' ' ' THR . 5.7 p-10 -79.33 175.03 10.98 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.439 -0.8 . . . . 74.099999999999994 112.682 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -118.06 -43.23 2.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.855 -0.612 . . . . 73.430000000000007 111.224 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.78 45.4 1.15 Allowed 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.252 0.464 . . . . 72.239999999999995 112.252 -175.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.433 ' HB ' ' OD2' ' A' ' 11' ' ' ASP . 6.0 t -65.5 -36.29 83.41 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.583 0.586 . . . . 74.019999999999996 112.583 -179.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.4 p -80.69 68.99 7.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.037 0.446 . . . . 61.439999999999998 111.741 -177.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.509 ' HE1' HH11 ' A' ' 55' ' ' ARG . 97.5 m-85 -62.65 -50.54 70.8 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.019 0.438 . . . . 64.510000000000005 111.56 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 114.25 -107.62 1.88 Allowed Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.291 -0.48 . . . . 72.140000000000001 113.009 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -79.02 109.16 13.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.132 0.491 . . . . 71.409999999999997 111.338 178.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 50' ' ' SER . 97.2 mt -120.92 117.47 27.41 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.97 -0.559 . . . . 74.239999999999995 111.222 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -102.62 139.06 38.7 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.987 0.423 . . . . 51.219999999999999 111.21 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 67.5 t80 -71.98 102.06 2.85 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.275 -0.421 . . . . 71.239999999999995 110.581 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.552 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.3 t -73.29 -64.83 0.9 Allowed 'General case' 0 N--CA 1.472 0.625 0 O-C-N 122.018 -0.426 . . . . 71.010000000000005 111.864 -175.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.57 171.67 17.65 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.608 0.596 . . . . 75.430000000000007 112.608 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.451 HD13 ' CE2' ' A' ' 46' ' ' TYR . 37.1 tp -90.06 105.83 18.07 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.853 -0.612 . . . . 73.109999999999999 109.486 169.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 25' ' ' ARG . 16.0 tpt180 -65.82 -53.14 43.96 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.487 -0.324 . . . . 75.409999999999997 111.546 -175.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -177.01 141.21 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.247 0.462 . . . . 74.230000000000004 112.247 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.41 98.89 11.51 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.647 -0.501 . . . . 71.019999999999996 109.647 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 42' ' ' LYS . 31.9 m -78.16 144.78 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-O 121.303 0.573 . . . . 74.5 111.773 -174.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm180 -109.56 168.35 9.46 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.949 -0.569 . . . . 65.209999999999994 112.109 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.0 mt -80.99 141.78 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.977 -0.556 . . . . 61.539999999999999 111.164 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -95.45 150.74 19.96 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.088 0.471 . . . . 72.129999999999995 111.707 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -93.55 155.45 17.3 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.489 -0.323 . . . . 62.509999999999998 110.427 174.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -62.19 -21.34 65.02 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.216 0.532 . . . . 74.430000000000007 111.344 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.54 -31.89 70.97 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.917 -0.583 . . . . 62.25 111.582 172.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.53 -34.86 4.47 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 116.222 -0.444 . . . . 51.340000000000003 112.156 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.7 m -68.14 153.92 42.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.004 0.431 . . . . 74.200000000000003 111.319 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -87.28 146.33 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 120.819 0.343 . . . . 73.430000000000007 111.5 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.9 t -90.53 172.4 8.73 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.213 0.53 . . . . 72.239999999999995 112.208 -179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -81.07 -15.54 55.72 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.998 -0.546 . . . . 63.32 110.628 173.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.08 135.87 56.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.817 -0.629 . . . . 74.299999999999997 110.75 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.93 142.96 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-O 120.929 0.395 . . . . 73.340000000000003 111.266 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HG23 ' A' ' 28' ' ' VAL . 29.1 tptp -98.31 -58.26 2.01 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.955 0.407 . . . . 55.200000000000003 111.267 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -164.4 166.44 20.65 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.089 0.471 . . . . 71.430000000000007 111.291 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 60' ' ' SER . 38.3 mtt180 -114.5 114.39 25.73 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.001 0.371 . . . . 75.329999999999998 112.001 -173.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.0 m -91.64 126.92 36.89 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.169 -0.469 . . . . 64.329999999999998 112.055 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CE2' HD13 ' A' ' 24' ' ' LEU . 92.8 m-85 -123.61 151.75 42.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.209 0.604 . . . . 73.209999999999994 111.527 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 22' ' ' SER . 69.5 m-20 -102.08 119.27 38.53 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.238 -0.437 . . . . 75.329999999999998 110.938 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.642 HD12 HG21 ' A' ' 59' ' ' VAL . 39.6 mt -114.55 141.22 48.02 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.987 0.422 . . . . 75.510000000000005 111.922 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HG2' ' HB2' ' A' ' 22' ' ' SER . 29.0 mmmt -96.21 124.54 40.25 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.0 -0.545 . . . . 73.099999999999994 111.121 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HA ' HD23 ' A' ' 19' ' ' LEU . 29.1 t -103.39 106.15 16.59 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.894 0.378 . . . . 52.299999999999997 111.477 177.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -74.3 140.77 45.14 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.005 0.431 . . . . 53.219999999999999 111.244 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 102.94 -62.82 0.45 Allowed Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.803 -0.519 . . . . 74.019999999999996 111.803 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -75.4 -22.85 57.12 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.992 0.425 . . . . 71.140000000000001 111.032 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.21 28.64 73.84 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 121.376 -0.44 . . . . 45.5 112.625 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.509 HH11 ' HE1' ' A' ' 16' ' ' PHE . 5.6 ptm180 -110.88 150.12 29.63 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.27 0.557 . . . . 62.049999999999997 111.448 -174.513 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.0 OUTLIER -110.16 131.25 55.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.897 -0.592 . . . . 63.520000000000003 110.904 175.821 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 100' ' ' ILE . 24.4 pt -115.02 142.99 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 116.523 -0.308 . . . . 64.420000000000002 111.359 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.4 mp0 -89.99 104.99 17.5 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.82 0.343 . . . . 71.140000000000001 110.572 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.642 HG21 HD12 ' A' ' 48' ' ' LEU . 87.2 t -100.6 129.94 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.079 -0.388 . . . . 70.540000000000006 111.424 -178.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.496 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 38.2 t -127.7 151.14 49.34 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.336 0.589 . . . . 62.43 112.275 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.9 pt -134.42 141.04 37.56 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 115.861 -0.609 . . . . 72.400000000000006 110.609 176.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.425 ' HG2' HG23 ' A' ' 65' ' ' VAL . 15.5 Cg_endo -56.35 152.25 40.25 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.4 2.067 . . . . 74.239999999999995 112.936 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.59 -30.12 19.82 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.301 0.852 . . . . 73.299999999999997 113.301 -177.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.5 p -67.26 -20.26 65.63 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.412 0.523 . . . . 64.530000000000001 112.412 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.425 HG23 ' HG2' ' A' ' 62' ' ' PRO . 53.2 t -84.78 132.27 46.79 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 120.536 0.208 . . . . 61.009999999999998 111.37 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.04 158.98 8.14 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.114 2.543 . . . . 74.140000000000001 113.818 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.5 tp -76.0 129.65 37.2 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.954 -0.566 . . . . 63.210000000000001 111.77 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 0.0 OUTLIER -86.88 123.46 32.04 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.113 0.482 . . . . 70.420000000000002 111.366 174.838 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -116.72 49.28 1.18 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.715 -0.675 . . . . 71.400000000000006 111.397 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -84.4 177.01 8.31 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.948 0.722 . . . . 72.5 112.948 -174.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.3 159.25 15.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.553 -0.749 . . . . 71.310000000000002 111.624 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.615 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.1 t80 -59.86 -35.35 74.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.298 0.481 . . . . 74.219999999999999 112.298 -179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -93.73 2.65 56.21 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 122.133 -0.355 . . . . 35.399999999999999 111.474 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.17 135.04 42.81 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.015 0.436 . . . . 62.229999999999997 111.802 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.604 HH11 ' HA ' ' A' ' 110' ' ' GLU . 82.5 mtt180 -79.53 126.42 30.85 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.166 -0.47 . . . . 54.310000000000002 110.327 176.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.2 m -129.28 142.45 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.284 0.564 . . . . 72.0 112.516 -178.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.25 170.53 14.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.928 -0.578 . . . . 64.129999999999995 110.773 177.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.3 133.36 55.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.866 0.365 . . . . 71.120000000000005 111.923 -176.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.425 HG22 ' OD1' ' A' ' 80' ' ' ASN . 50.1 mm -64.97 -65.58 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.158 -0.474 . . . . 63.119999999999997 111.645 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.5 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 26.1 m120 -129.04 89.24 49.18 Favored Pre-proline 0 N--CA 1.474 0.744 0 O-C-N 122.18 -0.325 . . . . 63.509999999999998 110.669 174.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.04 141.7 13.26 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.927 2.418 . . . . 72.319999999999993 114.07 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.5 pt -133.34 129.66 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.982 0.42 . . . . 63.43 110.787 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.86 114.26 8.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.865 0.364 . . . . 43.25 110.825 175.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -76.45 124.73 28.02 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.447 0.641 . . . . 71.420000000000002 111.878 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 34.0 p -117.27 30.32 7.38 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.676 -0.693 . . . . 71.310000000000002 111.067 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.4 t -112.68 -48.38 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 120.856 0.36 . . . . 74.400000000000006 111.509 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.75 -9.71 46.31 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.298 0.481 . . . . 72.25 112.298 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.1 p -63.86 95.96 0.12 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.94 0.4 . . . . 75.239999999999995 111.776 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 65.37 15.59 10.1 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.162 0.801 . . . . 41.210000000000001 113.162 174.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.4 t -72.34 -24.42 61.29 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.934 0.397 . . . . 75.329999999999998 111.695 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -81.12 161.06 24.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.051 0.453 . . . . 73.010000000000005 111.833 -176.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.1 pm0 -90.82 16.23 9.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.218 -0.446 . . . . 55.219999999999999 111.965 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -177.79 -41.53 0.06 OUTLIER Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.205 -0.522 . . . . 70.310000000000002 113.067 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.86 69.05 1.36 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.173 0.511 . . . . 43.5 112.25 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -83.44 97.01 8.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.388 -0.369 . . . . 71.319999999999993 110.521 173.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.8 m -124.12 168.3 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.214 0.531 . . . . 72.219999999999999 112.356 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.35 177.71 1.41 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.668 -0.696 . . . . 75.329999999999998 112.517 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.41 ' CH2' HD11 ' A' ' 100' ' ' ILE . 0.7 OUTLIER -72.74 152.28 41.71 Favored 'General case' 0 C--O 1.25 1.111 0 N-CA-C 114.618 1.34 . . . . 63.030000000000001 114.618 -167.683 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.508 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 51.6 m-85 -110.95 136.66 49.63 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.766 -1.561 . . . . 75.140000000000001 111.34 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 57' ' ' ILE . 51.1 mt -114.72 105.5 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.182 0.515 . . . . 72.319999999999993 109.62 171.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.506 ' O ' HG12 ' A' ' 82' ' ' ILE . 38.0 mtmt -96.19 133.1 40.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.996 0.427 . . . . 74.400000000000006 111.09 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.38 158.44 26.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.464 0.649 . . . . 72.140000000000001 112.702 -172.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 19.9 t70 -59.58 -37.48 78.61 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.263 -0.881 . . . . 71.310000000000002 110.976 171.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -170.7 152.86 3.88 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.866 -0.606 . . . . 64.530000000000001 110.787 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.416 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 68.0 mt -108.93 118.82 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.767 -0.652 . . . . 74.340000000000003 110.953 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -127.16 164.69 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 121.038 0.447 . . . . 71.150000000000006 112.071 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 90.6 mt -76.81 137.64 39.35 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.39 0.614 . . . . 73.010000000000005 112.236 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.418 HG22 ' N ' ' A' ' 109' ' ' LEU . 5.1 m -84.14 167.74 16.46 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.924 -0.58 . . . . 75.010000000000005 110.375 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.418 ' N ' HG22 ' A' ' 108' ' ' THR . 91.1 mt -59.14 102.36 0.13 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.132 0.492 . . . . 73.200000000000003 111.826 177.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.604 ' HA ' HH11 ' A' ' 75' ' ' ARG . 49.5 mt-10 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 118.577 -0.725 . . . . 51.219999999999999 110.983 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.803 0.335 . . . . 61.43 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 42.5 tpp -166.78 141.17 4.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.445 -0.343 . . . . 64.530000000000001 110.848 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -101.29 120.87 40.9 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.694 0.283 . . . . 75.310000000000002 111.097 177.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 4' ' ' LEU . 2.9 mm? -117.38 -176.76 3.07 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.1 0.476 . . . . 71.209999999999994 111.136 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -129.53 83.89 2.17 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.236 0.541 . . . . 70.319999999999993 110.968 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -80.51 76.28 7.35 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.33 0.586 . . . . 54.210000000000001 110.73 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.79 150.53 22.43 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.91 -0.662 . . . . 74.450000000000003 113.02 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 pt -111.19 -176.57 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 120.993 0.425 . . . . 72.439999999999998 111.638 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.414 ' O ' HG13 ' A' ' 9' ' ' VAL . 6.4 p -80.35 101.77 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.546 0.688 . . . . 72.319999999999993 111.132 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.529 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -70.94 -74.87 0.14 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.316 -0.402 . . . . 74.150000000000006 111.152 -179.247 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.408 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 3.1 m-20 -83.65 164.91 19.4 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.027 0.441 . . . . 54.210000000000001 111.404 173.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -67.77 136.98 55.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.949 -0.568 . . . . 72.200000000000003 111.536 -173.859 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -61.67 97.6 0.08 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.339 -0.392 . . . . 64.409999999999997 110.775 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 p -61.95 107.79 0.92 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.146 0.498 . . . . 74.5 111.44 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.6 127.08 33.87 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.327 0.584 . . . . 73.329999999999998 112.355 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -134.58 152.8 52.03 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.337 -0.392 . . . . 71.099999999999994 111.158 177.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.94 -109.42 1.88 Allowed Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.265 -0.493 . . . . 55.229999999999997 112.2 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -103.9 114.05 28.03 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.475 0.655 . . . . 55.200000000000003 111.215 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.4 mt -90.77 122.02 33.15 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 122.091 -0.381 . . . . 75.400000000000006 110.055 176.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -102.79 123.31 46.23 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.302 0.573 . . . . 64.530000000000001 112.198 -176.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -67.49 143.57 56.12 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.253 -0.885 . . . . 61.5 111.456 -179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -123.53 -62.94 1.27 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.792 0.294 . . . . 72.519999999999996 111.792 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.61 164.14 36.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.248 0.547 . . . . 65.340000000000003 112.327 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.61 115.04 9.32 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.888 -0.596 . . . . 75.420000000000002 110.707 173.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 8.4 tpt180 -73.04 -59.72 2.57 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.948 0.404 . . . . 71.349999999999994 111.493 -176.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -161.92 139.68 8.82 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.043 0.386 . . . . 70.200000000000003 112.043 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -99.8 99.96 10.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.396 -0.594 . . . . 73.239999999999995 109.396 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' HB2' ' A' ' 42' ' ' LYS . 16.0 m -68.19 87.98 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.784 0.802 . . . . 63.43 111.254 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 46.8 mtt180 -82.07 155.91 24.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.884 -0.598 . . . . 61.119999999999997 111.825 -176.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.651 HG12 ' HE2' ' A' ' 42' ' ' LYS . 54.2 mt -68.63 107.47 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 115.862 -0.608 . . . . 70.409999999999997 111.829 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.45 112.61 20.53 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.034 0.445 . . . . 64.030000000000001 110.227 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -60.04 164.72 3.79 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.798 -0.637 . . . . 61.539999999999999 112.51 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.2 -32.07 64.05 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.304 0.573 . . . . 72.420000000000002 110.911 176.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.24 -8.22 43.89 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.633 -0.712 . . . . 74.319999999999993 111.865 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.04 -3.49 82.62 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.231 -0.509 . . . . 73.120000000000005 113.027 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.4 p -84.15 155.21 22.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.859 0.361 . . . . 71.209999999999994 111.479 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 43.9 t -95.74 124.31 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.885 0.374 . . . . 75.319999999999993 111.563 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 t -85.7 152.72 22.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.353 -0.385 . . . . 60.009999999999998 111.446 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.85 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.937 0.398 . . . . 64.140000000000001 111.029 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.85 143.05 58.2 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.244 0.545 . . . . 71.319999999999993 111.806 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 31.1 mt -113.06 145.93 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 116.192 -0.458 . . . . 73.049999999999997 111.672 -175.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HE2' HG12 ' A' ' 30' ' ' ILE . 73.9 mmtt -78.76 -50.66 10.99 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.233 0.539 . . . . 52.310000000000002 110.176 170.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.84 168.18 8.93 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.732 -0.667 . . . . 74.340000000000003 111.404 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.3 mtt180 -114.87 117.19 29.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.694 0.398 . . . . 74.340000000000003 112.032 -173.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.1 m -96.32 132.42 41.82 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.338 -0.392 . . . . 74.319999999999993 111.788 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -122.97 153.97 39.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.679 0.391 . . . . 62.219999999999999 111.659 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.424 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 61.4 m-20 -88.48 113.17 23.78 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.693 0.282 . . . . 64.299999999999997 111.664 175.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 59' ' ' VAL . 67.5 mt -113.19 122.14 46.6 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.011 0.434 . . . . 75.230000000000004 110.865 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HE2' ' HG3' ' A' ' 56' ' ' MET . 1.1 mptm? -94.5 141.12 28.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.094 0.474 . . . . 74.319999999999993 112.076 -178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.45 ' HB2' ' HG2' ' A' ' 55' ' ' ARG . 19.6 m -108.89 107.7 18.19 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.786 -0.643 . . . . 74.099999999999994 110.514 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -58.91 153.41 17.36 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.198 0.523 . . . . 73.439999999999998 111.84 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.9 -45.88 3.38 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.246 -0.502 . . . . 74.239999999999995 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -85.08 -27.59 26.2 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.893 0.378 . . . . 65.109999999999999 111.139 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.38 43.59 94.73 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 121.427 -0.416 . . . . 34.509999999999998 113.132 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.45 ' HG2' ' HB2' ' A' ' 50' ' ' SER . 15.8 ptt180 -117.84 148.95 41.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.213 0.53 . . . . 72.219999999999999 111.86 -176.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.474 ' N ' ' SD ' ' A' ' 56' ' ' MET . 3.3 mpp? -111.8 108.4 17.79 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.824 -0.625 . . . . 74.109999999999999 110.055 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.5 pt -98.1 144.71 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.715 0.293 . . . . 72.0 111.091 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 87.4 mm-40 -97.48 105.05 17.13 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.055 0.455 . . . . 75.420000000000002 110.973 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.615 HG21 HD12 ' A' ' 48' ' ' LEU . 98.9 t -107.19 128.31 62.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 116.442 -0.345 . . . . 74.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 31.5 t -126.46 134.72 50.88 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.295 0.48 . . . . 63.329999999999998 112.295 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.6 pt -115.13 143.98 31.27 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 116.271 -0.422 . . . . 74.109999999999999 111.192 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.65 147.38 60.1 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.585 2.19 . . . . 74.099999999999994 113.193 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.03 -16.89 20.75 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.057 0.762 . . . . 45.439999999999998 113.057 -176.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 m -74.96 -4.53 38.73 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.025 0.38 . . . . 41.409999999999997 112.025 177.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.8 t -102.19 131.43 22.62 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 122.487 0.315 . . . . 74.400000000000006 111.201 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.99 146.03 17.91 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.003 2.468 . . . . 75.510000000000005 113.869 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.01 136.83 50.81 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.939 -0.573 . . . . 74.420000000000002 111.686 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -87.68 133.2 33.88 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.168 0.508 . . . . 75.420000000000002 112.12 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -117.9 30.92 6.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.644 -0.707 . . . . 64.299999999999997 111.161 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -64.54 161.39 17.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.637 0.606 . . . . 75.239999999999995 112.637 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -83.49 163.58 20.38 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.636 -0.711 . . . . 53.100000000000001 112.102 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -64.17 120.92 13.02 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.25 -0.432 . . . . 74.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 66.4 34.3 6.38 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 64.120000000000005 111.865 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.58 118.68 20.22 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.471 -0.331 . . . . 71.430000000000007 111.198 175.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -60.11 108.87 0.84 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.877 0.37 . . . . 63.43 111.663 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.483 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.85 169.75 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.407 0.622 . . . . 74.049999999999997 111.817 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.87 157.96 44.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.043 -0.526 . . . . 61.240000000000002 110.697 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 93.5 mt -102.65 126.55 49.79 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.944 0.35 . . . . 45.219999999999999 111.944 -175.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.471 HG22 ' OD1' ' A' ' 80' ' ' ASN . 50.2 mm -56.13 -59.99 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 116.266 -0.424 . . . . 73.329999999999998 111.622 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.528 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 28.1 m120 -137.03 91.56 14.82 Favored Pre-proline 0 N--CA 1.473 0.702 0 O-C-N 122.237 -0.289 . . . . 52.149999999999999 111.257 174.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.75 141.47 12.18 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.019 2.479 . . . . 73.510000000000005 113.615 176.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -141.78 131.26 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-O 121.042 0.449 . . . . 73.319999999999993 111.231 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.34 110.11 9.42 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.227 -0.296 . . . . 74.420000000000002 110.457 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -114.07 -146.59 0.41 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 121.2 -0.2 . . . . 74.319999999999993 111.264 -171.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 t -62.15 89.73 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.661 0.743 . . . . 74.329999999999998 112.494 -176.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.412 HG12 ' HB2' ' A' ' 98' ' ' TRP . 27.3 m -63.96 142.97 16.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 115.878 -0.601 . . . . 74.340000000000003 110.568 173.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.404 ' CB ' ' HB ' ' A' ' 96' ' ' VAL . . . -59.05 -32.13 69.48 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.587 0.588 . . . . 72.430000000000007 112.587 -173.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.4 p -67.75 -21.11 65.29 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.085 0.402 . . . . 73.420000000000002 112.085 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.32 -40.27 14.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.903 0.382 . . . . 54.130000000000003 111.809 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.3 t -81.47 -35.64 30.28 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.45 0.537 . . . . 65.420000000000002 112.45 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -94.47 120.19 34.33 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.084 0.469 . . . . 75.5 111.781 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -78.61 110.2 13.51 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.283 -0.417 . . . . 72.5 111.318 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 83.69 46.1 6.16 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 121.167 -0.54 . . . . 72.239999999999995 113.136 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -149.5 108.79 3.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 120.999 0.428 . . . . 35.329999999999998 111.82 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -80.25 64.57 5.11 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.571 0.7 . . . . 72.409999999999997 111.302 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 97' ' ' ASP . 18.1 t -95.07 161.78 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.945 -0.571 . . . . 64.510000000000005 111.141 -178.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.421 ' N ' HG12 ' A' ' 96' ' ' VAL . 15.0 m-20 -59.97 168.97 1.63 Allowed 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.652 0.982 . . . . 73.209999999999994 113.652 -176.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.412 ' HB2' HG12 ' A' ' 86' ' ' VAL . 3.3 p-90 -104.17 146.3 28.97 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-N 115.847 -0.615 . . . . 53.450000000000003 111.858 -177.223 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.437 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -112.67 126.65 55.62 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.54 -0.755 . . . . 65.230000000000004 112.946 -171.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.429 ' HB ' HG22 ' A' ' 59' ' ' VAL . 57.3 mt -111.07 115.93 51.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.197 -0.91 . . . . 54.130000000000003 110.291 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -84.8 134.85 34.3 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.078 -0.389 . . . . 75.340000000000003 110.898 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.1 143.96 50.92 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.227 0.537 . . . . 54.020000000000003 112.165 -176.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.0 t70 -65.01 -40.03 94.31 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.884 -0.598 . . . . 72.209999999999994 111.422 176.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.453 ' HB3' HG13 ' A' ' 79' ' ' ILE . 22.1 t0 -170.42 161.61 8.03 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 116.383 -0.371 . . . . 75.530000000000001 110.817 178.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 36.5 mt -122.66 122.13 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 116.527 -0.306 . . . . 74.120000000000005 111.302 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.7 m -126.35 176.57 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.64 0.257 . . . . 72.329999999999998 111.026 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.483 HD23 HG12 ' A' ' 76' ' ' VAL . 97.2 mt -76.05 145.41 40.17 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.176 -0.327 . . . . 63.140000000000001 111.417 177.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.9 m -62.69 119.45 9.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.595 0.236 . . . . 61.049999999999997 110.873 177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.1 mt 61.33 36.04 17.75 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.222 0.534 . . . . 64.420000000000002 111.106 -174.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 C--O 1.255 1.377 0 CA-C-N 115.597 -0.728 . . . . 73.430000000000007 112.189 177.961 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 mtm . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.572 0.225 . . . . 75.209999999999994 111.088 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 50.3 mtm -130.68 134.91 47.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.678 0.275 . . . . 72.120000000000005 111.37 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -81.2 155.67 26.03 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.147 0.498 . . . . 72.510000000000005 111.235 175.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.451 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.0 mm? -99.49 148.47 24.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 72.340000000000003 111.399 -178.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -112.13 90.98 3.49 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.337 -0.392 . . . . 71.239999999999995 111.895 -177.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -134.02 171.86 13.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.486 -0.324 . . . . 55.109999999999999 110.829 175.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.19 28.96 42.75 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 120.888 -0.672 . . . . 63.030000000000001 112.632 -176.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 33.0 pt -88.6 159.41 2.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.961 0.41 . . . . 63.310000000000002 111.588 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.9 t -102.87 128.47 55.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.826 0.346 . . . . 74.099999999999994 111.431 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.27 178.77 7.92 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.006 -0.543 . . . . 73.349999999999994 111.279 178.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -63.22 154.31 31.82 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 121.674 0.749 . . . . 53.439999999999998 112.519 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -155.59 -36.33 0.09 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.383 -0.826 . . . . 70.230000000000004 110.066 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -153.14 78.63 1.17 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.398 -0.819 . . . . 74.340000000000003 110.179 174.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -62.68 -20.39 64.81 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.784 -0.644 . . . . 64.549999999999997 112.688 -177.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.8 p -75.89 92.05 3.06 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.887 0.375 . . . . 71.099999999999994 111.12 178.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -64.61 118.86 9.48 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.34 -0.391 . . . . 61.439999999999998 111.387 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -71.12 -106.56 0.05 OUTLIER Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.068 -0.587 . . . . 65.120000000000005 113.069 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -95.3 124.8 39.53 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 122.362 -0.493 . . . . 74.400000000000006 111.996 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.6 mt -118.1 135.62 54.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.836 -0.62 . . . . 53.530000000000001 110.094 175.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD2' ' O ' ' A' ' 73' ' ' ASN . 46.9 mtmt -132.83 138.81 47.2 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 122.036 -0.415 . . . . 73.310000000000002 112.027 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -70.2 140.03 52.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.057 0.391 . . . . 70.329999999999998 112.057 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 94.8 p -125.97 -62.39 1.18 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.011 0.374 . . . . 75.129999999999995 112.011 177.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -149.98 -173.6 4.48 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.494 0.553 . . . . 73.319999999999993 112.494 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 tp -104.85 123.79 48.32 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.237 -0.438 . . . . 74.140000000000001 110.754 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -73.16 -64.75 0.91 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.095 0.406 . . . . 73.5 112.095 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -170.16 143.45 2.44 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.071 0.462 . . . . 72.120000000000005 111.905 -174.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.433 ' HG2' ' HG3' ' A' ' 44' ' ' ARG . 43.3 mt-10 -106.13 108.96 20.75 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.18 -0.464 . . . . 74.530000000000001 110.481 173.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -85.95 110.05 19.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 121.304 0.573 . . . . 64.230000000000004 111.17 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.682 ' HG2' HG12 ' A' ' 41' ' ' ILE . 73.7 mtm180 -99.9 178.48 4.8 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.474 0.654 . . . . 63.119999999999997 112.761 -174.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.06 124.17 39.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.496 -0.774 . . . . 71.5 110.639 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -98.35 133.78 42.28 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.999 0.428 . . . . 74.430000000000007 111.698 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -68.94 143.72 54.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.249 -0.432 . . . . 72.409999999999997 110.741 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.59 -17.68 48.02 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.139 0.495 . . . . 75.109999999999999 111.636 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.12 -39.75 71.86 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.069 0.461 . . . . 75.030000000000001 111.253 174.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.5 -46.22 0.82 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.372 -0.442 . . . . 73.439999999999998 112.916 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.2 p -61.46 160.79 10.42 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 120.991 0.424 . . . . 35.530000000000001 111.931 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.4 t -107.97 136.89 41.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-O 121.024 0.44 . . . . 75.109999999999999 111.793 -177.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 t -79.83 168.88 18.7 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.272 0.558 . . . . 73.439999999999998 111.895 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.42 -26.74 55.82 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 111.813 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 142.69 57.94 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.268 0.556 . . . . 53.539999999999999 111.453 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.682 HG12 ' HG2' ' A' ' 29' ' ' ARG . 24.1 mt -115.48 145.04 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 116.066 -0.516 . . . . 54.25 111.934 -172.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -78.58 -57.79 3.59 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.146 0.498 . . . . 72.439999999999998 110.389 173.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.44 167.75 25.02 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.157 0.503 . . . . 64.400000000000006 111.478 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.433 ' HG3' ' HG2' ' A' ' 27' ' ' GLU . 44.8 ttm180 -125.51 123.71 39.76 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.927 0.394 . . . . 72.349999999999994 111.752 -172.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 16.9 m -102.3 128.84 48.68 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 116.2 -0.455 . . . . 75.5 112.175 -177.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -109.9 160.26 16.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.71 0.404 . . . . 74.319999999999993 111.369 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.05 124.1 42.39 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.186 -0.461 . . . . 75.439999999999998 110.476 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.439 ' HB2' HG13 ' A' ' 57' ' ' ILE . 73.3 mt -123.52 130.32 52.51 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.151 0.5 . . . . 74.230000000000004 111.535 178.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.418 ' NZ ' ' HB3' ' A' ' 49' ' ' LYS . 1.8 mmmp? -80.77 128.57 33.79 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.444 -0.344 . . . . 75.430000000000007 110.64 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -112.85 136.29 52.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.235 0.458 . . . . 61.219999999999999 112.235 -175.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.3 90.56 7.16 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.232 -0.44 . . . . 71.120000000000005 111.036 173.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.09 -130.35 1.12 Allowed Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.707 -0.759 . . . . 73.109999999999999 113.824 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.06 28.39 0.11 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 112.913 0.708 . . . . 71.049999999999997 112.913 -174.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 77.0 20.25 76.22 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.808 -0.71 . . . . 70.109999999999999 113.557 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -115.96 156.61 25.93 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.825 0.345 . . . . 71.109999999999999 110.935 177.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -108.55 177.62 4.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.691 0.281 . . . . 72.430000000000007 110.492 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.439 HG13 ' HB2' ' A' ' 48' ' ' LEU . 36.4 pt -131.62 138.24 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.962 0.41 . . . . 44.439999999999998 111.81 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.51 ' NE2' ' HB2' ' A' ' 97' ' ' ASP . 78.4 mt-30 -104.74 105.68 15.86 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.033 0.444 . . . . 74.109999999999999 110.622 175.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 93.5 t -100.07 126.59 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.308 0.484 . . . . 51.200000000000003 112.308 -173.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 14.3 t -114.03 123.07 48.78 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.712 0.291 . . . . 65.019999999999996 111.749 -176.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 pt -114.03 155.1 45.85 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.543 -0.299 . . . . 74.319999999999993 111.368 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.27 138.73 80.23 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 122.778 2.319 . . . . 73.239999999999995 113.297 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.74 -13.81 62.43 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.668 0.618 . . . . 73.120000000000005 112.668 -176.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.1 m -73.83 0.67 12.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 120.938 0.399 . . . . 71.519999999999996 111.169 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 94.5 t -101.77 129.96 25.52 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 122.816 0.446 . . . . 74.230000000000004 110.849 176.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.46 156.18 27.5 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.658 2.239 . . . . 74.120000000000005 113.438 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.553 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 39.7 tp -69.45 145.75 52.53 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.088 -0.506 . . . . 71.109999999999999 111.563 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.488 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 13.5 mptt -93.62 -66.13 0.94 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.986 0.736 . . . . 51.329999999999998 112.986 -176.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.1 mt-10 60.88 49.28 6.09 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.861 0.319 . . . . 65.439999999999998 111.861 -177.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.51 176.41 1.11 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.479 0.657 . . . . 63.310000000000002 112.644 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 16.7 m-20 -71.77 153.85 41.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.703 -0.68 . . . . 73.329999999999998 111.843 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -67.49 119.57 12.52 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.95 -0.568 . . . . 70.230000000000004 111.263 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 40.5 m-80 61.97 34.33 16.8 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.584 0.587 . . . . 74.319999999999993 112.584 -177.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -88.03 142.18 27.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.719 -0.219 . . . . 73.019999999999996 111.142 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -62.18 115.96 4.58 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.383 0.611 . . . . 63.5 112.388 179.837 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HD23 ' A' ' 107' ' ' LEU . 33.5 m -125.31 146.94 30.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.587 -0.733 . . . . 71.420000000000002 111.208 177.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -125.65 162.99 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.313 0.577 . . . . 73.219999999999999 111.316 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 59' ' ' VAL . 86.7 mt -110.17 137.67 47.59 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.226 -0.443 . . . . 75.219999999999999 111.731 -176.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -67.11 -68.42 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 116.286 -0.416 . . . . 65.109999999999999 110.925 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 102' ' ' ALA . 80.9 m-20 -122.72 85.99 49.56 Favored Pre-proline 0 N--CA 1.473 0.693 0 CA-C-N 116.679 -0.237 . . . . 75.019999999999996 111.191 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.73 129.81 6.52 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.808 2.339 . . . . 64.430000000000007 113.449 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.8 pt -137.86 130.97 41.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 121.162 0.506 . . . . 70.230000000000004 111.046 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.66 127.65 32.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.775 0.321 . . . . 72.510000000000005 111.425 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.43 131.63 51.66 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.152 0.427 . . . . 72.510000000000005 112.152 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -76.42 80.63 3.14 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.549 0.69 . . . . 73.219999999999999 109.43 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.504 HG22 ' H ' ' A' ' 87' ' ' ALA . 10.7 p -125.34 174.0 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 115.477 -0.783 . . . . 74.400000000000006 110.894 -172.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.504 ' H ' HG22 ' A' ' 86' ' ' VAL . . . 79.5 -57.87 0.39 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.341 0.657 . . . . 43.409999999999997 111.714 176.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.0 t -62.08 -12.43 19.15 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.058 0.392 . . . . 75.219999999999999 112.058 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -102.37 0.72 34.48 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.017 0.377 . . . . 42.039999999999999 112.017 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 84.1 m -119.08 -38.55 3.04 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.254 0.549 . . . . 62.210000000000001 111.045 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -93.65 -177.74 4.48 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.017 -0.538 . . . . 70.530000000000001 110.675 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -65.76 -16.34 63.7 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.186 0.517 . . . . 75.129999999999995 111.351 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 101.36 54.84 0.93 Allowed Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.162 -0.472 . . . . 64.329999999999998 113.011 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.36 2.14 20.5 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.304 0.573 . . . . 52.299999999999997 111.347 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -82.52 107.58 15.27 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.227 0.536 . . . . 63.549999999999997 111.148 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.9 t -87.94 -34.59 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.049 0.452 . . . . 73.219999999999999 111.548 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.51 ' HB2' ' NE2' ' A' ' 58' ' ' GLN . 5.4 m-20 -84.66 146.93 27.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.088 -0.506 . . . . 72.439999999999998 111.16 -178.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -82.83 142.18 31.72 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.651 0.739 . . . . 73.530000000000001 112.607 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.2 138.93 34.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.483 -0.78 . . . . 63.119999999999997 112.061 -178.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 50.5 mt -124.67 114.64 41.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 115.724 -0.671 . . . . 74.200000000000003 110.142 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -83.4 139.12 33.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.068 -0.395 . . . . 64.209999999999994 110.387 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 80' ' ' ASN . . . -141.16 160.49 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.29 0.566 . . . . 54.039999999999999 112.39 -175.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.426 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 34.7 t70 -63.01 -55.39 26.04 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.606 -0.725 . . . . 60.109999999999999 110.986 175.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -163.19 164.85 25.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.11 -0.495 . . . . 74.239999999999995 110.896 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.488 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 52.3 mt -115.04 117.34 55.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.087 0.555 . . . . 74.219999999999999 111.234 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.34 175.28 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.154 -0.341 . . . . 74.540000000000006 111.425 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.401 HD23 HG12 ' A' ' 76' ' ' VAL . 96.4 mt -77.12 138.13 39.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.723 0.297 . . . . 74.219999999999999 111.45 178.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.5 m -61.74 138.16 58.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.902 0.382 . . . . 60.43 111.758 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.6 mt -71.71 80.14 0.85 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 63.340000000000003 111.863 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.664 -0.684 . . . . 74.430000000000007 110.689 175.351 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.673 0.273 . . . . 63.009999999999998 110.976 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 34.4 tpp -148.95 152.92 37.19 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.874 0.369 . . . . 64.109999999999999 111.249 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -98.25 18.96 15.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.125 0.417 . . . . 61.240000000000002 112.125 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -113.43 -179.88 3.77 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.894 0.378 . . . . 65.430000000000007 111.574 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.48 134.8 55.05 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.46 -0.336 . . . . 63.109999999999999 111.164 179.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -106.44 -26.91 11.24 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 111.887 0.329 . . . . 74.239999999999995 111.887 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.31 116.29 1.31 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 121.162 -0.542 . . . . 75.129999999999995 112.997 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 34.4 pt -86.58 136.84 22.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 121.335 0.588 . . . . 35.109999999999999 112.214 -177.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.63 -47.14 72.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 121.285 0.564 . . . . 75.340000000000003 110.931 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -150.35 -177.3 5.87 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.936 -0.575 . . . . 74.230000000000004 111.054 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -60.87 102.84 0.22 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.163 0.506 . . . . 75.519999999999996 110.94 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.44 ' HE3' ' HB3' ' A' ' 12' ' ' LYS . 1.0 OUTLIER -56.51 138.75 51.25 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.667 -0.697 . . . . 72.549999999999997 112.705 -172.704 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.444 ' CG ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -47.86 102.56 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.702 -0.681 . . . . 65.450000000000003 111.779 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.8 t -124.81 -35.91 2.64 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.083 0.468 . . . . 71.129999999999995 111.226 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.2 p -88.45 83.41 6.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.228 0.537 . . . . 75.129999999999995 110.707 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -82.28 142.89 31.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.12 -0.491 . . . . 72.439999999999998 111.529 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -73.21 -157.34 4.15 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.743 -0.741 . . . . 43.109999999999999 111.842 171.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.61 107.97 2.29 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.049 -0.677 . . . . 73.420000000000002 110.816 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 95.3 mt -74.75 127.65 33.67 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.773 0.32 . . . . 63.299999999999997 110.58 177.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HB2' ' HD3' ' A' ' 49' ' ' LYS . 57.6 mttp -112.78 130.77 55.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.911 0.386 . . . . 61.409999999999997 111.387 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.85 132.39 48.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.92 -0.582 . . . . 63.119999999999997 111.207 177.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 m -116.75 -64.31 1.33 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.894 0.378 . . . . 72.519999999999996 111.607 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.68 -175.41 5.14 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.06 0.457 . . . . 70.439999999999998 111.894 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -105.89 107.24 18.14 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.166 -0.47 . . . . 72.400000000000006 110.127 175.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -59.01 -52.88 63.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.547 0.573 . . . . 73.329999999999998 112.547 -174.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -174.42 134.93 0.41 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.77 0.656 . . . . 51.219999999999999 112.77 -174.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -105.18 106.16 16.53 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.34 -0.391 . . . . 73.040000000000006 110.351 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -78.36 113.1 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.066 0.46 . . . . 72.329999999999998 111.505 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.645 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 96.0 mtt180 -79.95 161.96 25.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.278 0.561 . . . . 74.549999999999997 112.375 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -77.01 105.5 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 115.721 -0.672 . . . . 74.0 111.267 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.437 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 64.4 tt0 -77.85 121.18 23.76 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.891 0.377 . . . . 72.439999999999998 111.23 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -65.84 147.21 53.74 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.942 0.401 . . . . 74.109999999999999 111.574 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -63.33 -13.96 44.66 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.122 -0.49 . . . . 74.200000000000003 111.465 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.51 -23.93 61.08 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.049 0.452 . . . . 74.319999999999993 111.342 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.75 -42.87 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.442 -0.408 . . . . 72.209999999999994 112.97 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.0 m -74.5 159.88 31.66 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.093 0.473 . . . . 73.120000000000005 111.903 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 50.1 t -92.59 137.08 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.889 0.376 . . . . 55.329999999999998 111.527 -178.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.8 t -79.64 179.67 7.37 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.396 0.617 . . . . 73.340000000000003 111.884 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -78.49 -44.95 23.23 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.034 -0.53 . . . . 74.209999999999994 110.997 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -72.82 157.6 37.16 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.244 0.831 . . . . 62.520000000000003 113.244 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 34.2 mt -104.06 152.44 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.442 -0.799 . . . . 53.329999999999998 111.699 -176.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -91.95 -58.34 2.43 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.045 0.45 . . . . 73.530000000000001 111.254 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -153.97 160.66 42.16 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 120.882 0.372 . . . . 65.109999999999999 111.217 176.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 44' ' ' ARG . 5.5 ptp85 -125.63 126.44 44.73 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.563 0.579 . . . . 54.299999999999997 112.563 -174.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 88.8 m -96.6 129.12 44.05 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.735 -0.666 . . . . 65.319999999999993 111.991 -178.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.441 ' OH ' HD12 ' A' ' 67' ' ' LEU . 66.1 m-85 -107.82 163.53 13.04 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 121.23 0.538 . . . . 71.299999999999997 112.138 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -106.94 108.35 19.82 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.58 -0.736 . . . . 73.519999999999996 111.472 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.9 mt -122.64 125.92 46.6 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 122.29 -0.256 . . . . 74.409999999999997 110.895 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HD3' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -94.11 134.48 36.5 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.87 -0.518 . . . . 70.439999999999998 112.022 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.9 t -100.91 118.76 37.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.149 -0.478 . . . . 71.049999999999997 111.442 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -66.6 123.84 21.18 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.52 -0.309 . . . . 71.5 111.474 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.51 -31.39 6.91 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.268 -0.491 . . . . 75.109999999999999 113.598 177.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -96.26 -12.83 23.97 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 117.256 0.528 . . . . 44.32 112.02 -177.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.1 12.83 66.1 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 114.28 0.472 . . . . 63.329999999999998 114.28 177.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.444 HH21 ' CG ' ' A' ' 13' ' ' ASP . 38.7 ptt180 -138.44 160.42 39.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 122.261 -0.553 . . . . 73.120000000000005 111.942 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.476 ' SD ' ' N ' ' A' ' 56' ' ' MET . 1.5 pmm? -102.14 147.69 26.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.857 -0.611 . . . . 72.310000000000002 111.377 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.8 pt -103.52 137.82 30.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 111.025 177.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -93.45 104.68 16.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.182 -0.463 . . . . 70.420000000000002 110.394 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -105.36 112.43 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.813 0.34 . . . . 64.310000000000002 111.728 -175.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 98.2 p -103.91 130.74 51.54 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.269 0.557 . . . . 72.319999999999993 111.874 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -125.21 152.36 70.81 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 111.095 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.78 142.54 41.38 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.716 2.277 . . . . 73.400000000000006 113.508 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.52 -30.81 69.97 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.925 0.393 . . . . 52.140000000000001 111.966 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.9 t -61.08 -22.74 64.9 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.087 0.47 . . . . 74.439999999999998 111.306 176.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.83 127.81 84.76 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 116.462 -0.336 . . . . 55.329999999999998 110.547 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.38 144.01 92.56 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.917 2.411 . . . . 74.430000000000007 113.741 -175.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.441 HD12 ' OH ' ' A' ' 46' ' ' TYR . 24.3 tp -60.45 146.71 43.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.468 -0.787 . . . . 63.299999999999997 110.608 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 68' ' ' LYS . 3.6 mptp? -88.09 -56.79 3.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.95 0.722 . . . . 63.210000000000001 112.95 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 59.65 21.95 10.65 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.569 0.581 . . . . 73.030000000000001 112.569 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.21 164.98 14.64 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.2 0.524 . . . . 51.43 112.172 -177.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -65.1 146.91 54.37 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.432 0.634 . . . . 60.310000000000002 112.568 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.09 123.94 19.49 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.434 -0.803 . . . . 73.439999999999998 111.627 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 71.03 16.71 6.36 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.21 0.604 . . . . 64.430000000000007 112.53 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.21 149.06 32.03 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.149 -0.344 . . . . 75.109999999999999 111.09 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.56 123.85 22.38 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.911 0.386 . . . . 74.519999999999996 111.427 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.462 HG12 HD23 ' A' ' 107' ' ' LEU . 30.4 m -127.21 140.47 49.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 121.052 0.453 . . . . 63.140000000000001 111.075 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -123.73 153.33 41.04 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.202 0.525 . . . . 72.510000000000005 111.151 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.422 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.7 mt -93.61 146.46 23.8 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.195 -0.457 . . . . 71.549999999999997 111.732 -177.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -77.0 -67.32 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.24 -0.436 . . . . 62.229999999999997 111.005 176.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.408 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 25.9 m120 -124.42 88.19 53.4 Favored Pre-proline 0 N--CA 1.473 0.714 0 O-C-N 122.2 -0.312 . . . . 61.039999999999999 110.838 174.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.409 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . 85.8 Cg_endo -82.32 128.52 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.946 2.431 . . . . 73.430000000000007 113.868 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.6 pt -137.58 123.83 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.166 0.508 . . . . 62.439999999999998 111.02 171.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 142.42 48.79 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 122.121 -0.362 . . . . 74.129999999999995 110.381 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -119.78 143.41 47.85 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.317 0.58 . . . . 73.409999999999997 112.095 -175.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.2 p -84.42 6.62 22.6 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.939 -0.573 . . . . 42.329999999999998 111.878 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.38 -32.3 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 40.310000000000002 111.177 176.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.95 -57.54 4.47 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.266 -0.425 . . . . 75.340000000000003 111.411 177.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.6 p -60.46 -18.06 48.92 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 112.737 0.643 . . . . 71.040000000000006 112.737 -176.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.1 -40.27 84.83 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.871 0.367 . . . . 70.409999999999997 111.798 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.8 t -108.6 -34.98 6.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.011 0.434 . . . . 72.140000000000001 111.509 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -75.57 104.95 6.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.889 0.376 . . . . 75.400000000000006 111.519 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.39 118.63 13.44 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.302 -0.408 . . . . 71.140000000000001 111.826 178.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 79.58 -108.1 2.67 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 121.423 -0.418 . . . . 73.430000000000007 113.912 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -153.39 137.63 16.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.971 0.415 . . . . 31.329999999999998 111.847 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -124.82 32.0 5.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.068 0.461 . . . . 75.510000000000005 111.227 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 68.2 t 74.81 -60.01 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.565 0.746 . . . . 72.030000000000001 112.669 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.61 152.54 23.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.158 0.504 . . . . 74.400000000000006 111.266 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -149.23 164.76 33.88 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.101 0.477 . . . . 74.230000000000004 111.63 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -111.05 128.65 55.93 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.029 0.751 . . . . 61.219999999999999 113.029 -171.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 66.4 mt -120.57 128.36 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.279 -0.873 . . . . 72.109999999999999 110.527 177.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.35 131.4 42.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.905 0.383 . . . . 74.299999999999997 110.278 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.65 162.92 24.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.513 0.673 . . . . 72.530000000000001 112.605 -176.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 26.8 t70 -78.3 -40.55 36.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.19 -0.914 . . . . 62.409999999999997 111.425 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -169.44 155.89 6.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.003 0.43 . . . . 73.349999999999994 111.46 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.454 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 31.7 mt -120.92 118.68 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 115.892 -0.595 . . . . 74.450000000000003 110.722 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.9 m -122.75 168.93 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 120.934 0.397 . . . . 73.010000000000005 111.626 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.462 HD23 HG12 ' A' ' 76' ' ' VAL . 69.2 mt -74.73 133.57 42.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.809 0.338 . . . . 71.439999999999998 111.494 176.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.36 137.35 58.24 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.475 -0.33 . . . . 71.219999999999999 110.381 176.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.17 12.62 0.41 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.093 0.775 . . . . 74.329999999999998 113.093 -173.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--O 1.25 1.114 0 C-N-CA 123.696 0.798 . . . . 71.25 112.822 176.464 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.439 ' N ' ' OE1' ' A' ' 31' ' ' GLN . 64.3 mtt . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.615 0.245 . . . . 74.200000000000003 111.278 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -176.11 150.1 0.93 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.881 0.372 . . . . 64.209999999999994 111.476 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -110.02 111.41 22.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.306 -0.406 . . . . 74.340000000000003 110.412 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.09 123.33 28.3 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.249 0.547 . . . . 72.430000000000007 112.247 -177.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -105.08 104.2 13.89 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.95 -0.568 . . . . 74.299999999999997 110.849 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -114.23 171.88 7.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.27 0.557 . . . . 74.230000000000004 111.89 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -156.57 -96.99 0.13 Allowed Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.794 -0.639 . . . . 44.130000000000003 112.107 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 40.5 pt -110.03 171.03 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.928 0.394 . . . . 72.319999999999993 111.413 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.6 p -147.99 113.06 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.257 0.551 . . . . 74.420000000000002 110.835 174.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -113.2 -178.14 3.31 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.221 -0.445 . . . . 61.229999999999997 111.905 -177.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -64.25 110.35 2.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.04 -0.527 . . . . 74.299999999999997 112.374 -175.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -130.82 -173.19 3.01 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.03 0.443 . . . . 63.229999999999997 111.413 175.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.01 119.08 14.61 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.528 0.566 . . . . 63.399999999999999 112.528 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 t -93.21 -50.57 5.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.958 -0.565 . . . . 63.240000000000002 110.503 171.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.1 m 67.26 -65.25 0.23 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.62 1.341 . . . . 65.430000000000007 114.62 170.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -52.48 -32.13 38.44 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.56 0.948 . . . . 65.310000000000002 113.56 -170.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 68.53 -113.79 5.53 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 121.021 -0.609 . . . . 74.019999999999996 113.155 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' A' ' 18' ' ' GLU . 7.3 pt-20 -83.85 108.63 16.98 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.352 0.596 . . . . 73.349999999999994 111.767 179.507 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 96.8 mt -88.85 153.43 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.933 -0.479 . . . . 73.530000000000001 111.306 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.518 ' HE2' ' N ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -102.62 112.93 25.9 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.483 -0.326 . . . . 75.120000000000005 111.075 176.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.453 ' HE1' ' CD1' ' A' ' 46' ' ' TYR . 86.0 t80 -78.82 113.25 16.74 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.254 -0.43 . . . . 73.25 111.742 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.6 p -101.19 -60.09 1.59 Allowed 'General case' 0 N--CA 1.474 0.741 0 O-C-N 122.109 -0.37 . . . . 70.219999999999999 111.919 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.16 173.95 15.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.91 0.707 . . . . 42.240000000000002 112.91 -178.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -92.65 116.65 29.2 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.525 -0.761 . . . . 73.420000000000002 110.984 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 19.3 tpt180 -71.51 -54.61 10.0 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.405 0.52 . . . . 72.239999999999995 112.405 -173.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -164.7 146.9 8.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.081 0.467 . . . . 75.25 111.922 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.4 mt-10 -114.03 99.39 7.61 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.018 -0.537 . . . . 64.209999999999994 110.501 175.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -71.91 120.57 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.358 0.599 . . . . 70.340000000000003 110.702 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.2 mtt180 -98.16 165.94 11.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.349 0.595 . . . . 64.040000000000006 112.301 -173.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.9 mt -69.34 112.51 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.659 -0.7 . . . . 72.140000000000001 111.319 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' A' ' 1' ' ' MET . 58.3 tt0 -86.51 120.18 27.56 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.14 -0.482 . . . . 60.549999999999997 110.838 -178.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.05 173.7 5.25 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.132 0.79 . . . . 74.439999999999998 113.132 -174.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -53.98 -41.5 67.97 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.55 -0.75 . . . . 65.109999999999999 112.344 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.7 -26.93 68.88 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.068 0.461 . . . . 72.340000000000003 112.053 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.14 -15.97 30.34 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.07 -0.586 . . . . 25.140000000000001 111.788 -171.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 m -72.14 137.84 47.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.006 0.431 . . . . 40.140000000000001 110.9 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.6 t -82.08 144.31 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-N 116.372 -0.377 . . . . 73.25 111.876 -175.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.8 t -95.3 176.44 6.21 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.915 0.388 . . . . 54.329999999999998 111.794 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -80.11 -29.87 39.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.943 0.401 . . . . 73.540000000000006 111.252 177.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.03 138.97 58.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.277 -0.42 . . . . 71.109999999999999 111.031 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.3 mt -101.81 147.93 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 112.059 0.392 . . . . 52.420000000000002 112.059 -175.085 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -94.74 -57.31 2.5 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 116.535 -0.302 . . . . 63.119999999999997 110.87 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -152.26 165.7 34.07 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.986 0.422 . . . . 64.129999999999995 111.857 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.54 ' HD3' HD13 ' A' ' 67' ' ' LEU . 64.9 mtt180 -128.8 137.66 51.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.932 0.396 . . . . 73.430000000000007 112.049 -172.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.4 m -113.57 132.49 55.7 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.369 -0.378 . . . . 62.340000000000003 111.936 -177.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.514 ' OH ' HD12 ' A' ' 67' ' ' LEU . 51.5 m-85 -109.6 157.67 18.8 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 120.774 0.321 . . . . 74.310000000000002 111.751 178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.42 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 55.3 m-20 -92.45 106.77 18.7 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.295 -0.411 . . . . 74.409999999999997 110.233 169.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.455 HD12 HG21 ' A' ' 59' ' ' VAL . 58.9 mt -115.45 134.08 55.43 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.146 0.498 . . . . 71.530000000000001 111.846 -178.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -93.96 128.74 40.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.162 -0.472 . . . . 72.409999999999997 111.003 177.81 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 61.5 p -91.88 165.9 13.0 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.479 0.548 . . . . 53.219999999999999 112.479 -175.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.649 ' HE2' ' HA ' ' A' ' 51' ' ' LYS . 8.3 mmpt? -96.68 -178.16 4.16 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.135 -0.484 . . . . 73.319999999999993 111.543 177.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.4 -85.85 0.05 OUTLIER Glycine 0 CA--C 1.525 0.706 0 C-N-CA 121.161 -0.542 . . . . 51.119999999999997 113.04 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -74.82 -31.63 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.87 0.367 . . . . 64.530000000000001 111.151 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.68 53.58 8.23 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 120.935 -0.65 . . . . 75.439999999999998 114.346 175.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -111.82 160.87 16.94 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.412 0.625 . . . . 71.430000000000007 111.938 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.8 OUTLIER -87.72 125.12 34.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.449 -0.796 . . . . 74.030000000000001 110.86 176.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 100' ' ' ILE . 27.0 pt -125.5 141.12 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.975 0.417 . . . . 75.030000000000001 111.823 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 22.1 mp0 -95.68 105.93 17.98 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.989 0.424 . . . . 62.219999999999999 111.325 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 100' ' ' ILE . 93.4 t -100.01 128.47 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.652 0.263 . . . . 72.409999999999997 111.218 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 22.6 t -118.33 138.96 52.04 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.325 0.491 . . . . 73.310000000000002 112.325 -174.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.429 HG21 HG13 ' A' ' 105' ' ' ILE . 44.7 pt -133.76 149.01 70.74 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.282 -0.417 . . . . 71.25 111.109 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.44 145.48 94.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.433 2.089 . . . . 72.010000000000005 113.125 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -6.07 19.53 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.975 0.417 . . . . 64.420000000000002 112.073 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 55.3 p -74.02 -20.83 60.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.183 0.516 . . . . 74.340000000000003 110.679 172.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.6 t -89.78 124.8 62.93 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 115.849 -0.614 . . . . 73.200000000000003 110.864 177.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -49.73 126.42 16.44 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.813 2.342 . . . . 75.540000000000006 113.448 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.612 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 29.4 tp -56.75 126.32 26.34 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.106 -0.497 . . . . 64.109999999999999 111.074 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -69.72 -63.07 1.15 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.923 0.712 . . . . 74.340000000000003 112.923 -170.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.612 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 36.7 mt-10 56.25 45.61 22.79 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.757 0.651 . . . . 62.200000000000003 112.757 176.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -75.6 -169.17 0.98 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.824 0.345 . . . . 73.040000000000006 111.854 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -74.94 164.73 26.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.627 0.603 . . . . 64.450000000000003 112.627 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -70.92 125.4 26.73 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.863 -0.608 . . . . 72.109999999999999 111.113 -178.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 59.16 31.54 21.35 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 122.854 0.462 . . . . 71.120000000000005 111.878 -175.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.65 150.8 30.84 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.517 -0.31 . . . . 75.540000000000006 111.518 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.463 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 99.3 mtt180 -68.49 106.19 2.47 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.299 0.481 . . . . 73.120000000000005 112.299 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 35.7 m -123.2 141.65 42.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.422 -0.354 . . . . 75.340000000000003 111.095 174.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -128.82 164.71 22.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.333 0.587 . . . . 75.329999999999998 111.391 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.454 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.5 mt -102.24 136.65 41.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.968 -0.56 . . . . 62.409999999999997 112.025 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.425 HG22 ' OD1' ' A' ' 80' ' ' ASN . 49.7 mm -70.96 -76.14 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.184 -0.462 . . . . 72.230000000000004 111.417 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.425 ' OD1' HG22 ' A' ' 79' ' ' ILE . 24.6 m120 -121.25 85.39 41.88 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.171 -0.33 . . . . 61.420000000000002 110.525 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -82.46 149.07 14.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.113 2.542 . . . . 51.409999999999997 114.703 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.7 pt -128.58 139.69 51.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.171 0.51 . . . . 73.549999999999997 110.122 168.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.66 105.75 17.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.286 -0.416 . . . . 71.519999999999996 111.859 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -81.9 49.41 1.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.293 0.568 . . . . 74.319999999999993 112.023 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 69.3 p -59.85 -44.21 94.24 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.929 0.395 . . . . 74.340000000000003 111.721 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -59.4 -18.26 14.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.831 0.678 . . . . 70.219999999999999 112.831 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -44.11 86.08 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.749 0.309 . . . . 73.200000000000003 111.655 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 78.7 p -63.37 -58.74 6.11 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.908 0.385 . . . . 72.439999999999998 111.34 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' A' ' 93' ' ' GLY . . . -56.05 -36.9 68.55 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.487 0.551 . . . . 55.109999999999999 112.487 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.7 m -76.05 -53.99 7.52 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.408 0.521 . . . . 64.430000000000007 112.408 -177.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.86 -32.38 19.03 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.991 0.737 . . . . 44.219999999999999 112.991 -171.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -135.64 75.23 1.55 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 111.974 0.361 . . . . 74.150000000000006 111.974 -175.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 89' ' ' ALA . . . 44.75 -90.49 0.01 OUTLIER Glycine 0 CA--C 1.53 0.973 0 CA-C-N 115.893 -0.594 . . . . 71.109999999999999 114.463 176.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.37 80.03 0.67 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.116 0.566 . . . . 74.219999999999999 110.459 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -90.99 166.6 12.93 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.158 0.429 . . . . 61.340000000000003 112.158 -173.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.94 -39.95 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 113.133 0.79 . . . . 50.200000000000003 113.133 -172.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 140.64 30.6 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.315 0.579 . . . . 72.409999999999997 111.03 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 -139.4 165.44 27.2 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.023 -0.535 . . . . 72.319999999999993 112.238 -170.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.433 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 76.2 m-85 -105.16 154.22 20.48 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.749 -0.66 . . . . 70.340000000000003 112.253 -177.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 57' ' ' ILE . 66.7 mt -135.85 107.39 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.427 -0.806 . . . . 64.200000000000003 109.76 175.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.3 mtpp -86.13 120.88 27.99 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.363 0.601 . . . . 72.239999999999995 111.101 -177.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.09 144.33 43.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.098 0.475 . . . . 71.040000000000006 112.165 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -56.31 -44.38 79.84 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.895 -0.593 . . . . 73.150000000000006 111.133 173.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -165.34 158.09 15.82 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.162 -0.472 . . . . 75.329999999999998 110.95 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.485 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 23.8 mt -123.43 122.46 65.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.093 -0.503 . . . . 60.340000000000003 110.915 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.5 m -124.62 177.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.608 0.242 . . . . 62.32 111.261 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.4 mt -76.96 137.91 39.33 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 122.411 -0.181 . . . . 74.510000000000005 110.792 174.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 32.5 m -54.95 132.62 47.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.755 0.312 . . . . 42.210000000000001 111.296 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.01 -28.59 17.6 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.815 0.672 . . . . 74.109999999999999 112.815 -176.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.431 ' H ' HG22 ' A' ' 108' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.254 1.317 0 CA-C-O 118.894 -0.574 . . . . 62.149999999999999 111.861 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.492 1.67 0 N-CA-C 111.754 0.279 . . . . 72.239999999999995 111.754 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.439 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -145.43 138.95 26.55 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.026 0.441 . . . . 75.310000000000002 111.743 -179.68 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -98.42 -6.21 30.99 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.296 -0.411 . . . . 74.140000000000001 112.025 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.494 ' HB3' HG13 ' A' ' 86' ' ' VAL . 3.9 pp -60.25 164.85 3.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.915 0.709 . . . . 71.420000000000002 112.915 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -127.6 156.2 42.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.094 -0.503 . . . . 71.219999999999999 111.695 178.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -90.75 7.16 41.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 120.957 0.408 . . . . 63.409999999999997 111.539 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -144.18 152.07 23.97 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 116.366 -0.379 . . . . 44.409999999999997 112.359 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 33.5 pt -105.04 177.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.466 0.651 . . . . 72.510000000000005 112.608 -175.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.5 t -77.94 -65.49 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 CA-C-N 115.759 -0.655 . . . . 53.530000000000001 110.881 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -157.54 171.7 19.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.335 -0.393 . . . . 71.219999999999999 111.472 178.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -125.0 166.67 15.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.225 -0.443 . . . . 72.540000000000006 110.947 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -153.08 -53.02 0.11 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.655 0.264 . . . . 75.439999999999998 110.903 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -147.52 114.08 6.0 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.227 0.537 . . . . 64.120000000000005 112.182 174.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.7 p -131.12 78.87 1.86 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.981 -0.554 . . . . 73.510000000000005 110.575 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 33.7 p -128.66 -52.06 1.25 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.294 -0.412 . . . . 53.130000000000003 111.652 -177.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.636 ' HB3' ' HB3' ' A' ' 50' ' ' SER . 53.1 m-85 61.92 17.39 8.89 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.509 0.559 . . . . 73.420000000000002 112.509 175.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 70.22 -112.51 4.39 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 121.022 -0.609 . . . . 41.399999999999999 112.835 -177.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -101.4 109.06 20.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.024 0.44 . . . . 74.439999999999998 111.501 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.44 126.29 33.12 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.475 -0.329 . . . . 72.209999999999994 110.291 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -127.84 133.47 49.38 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.146 0.498 . . . . 73.140000000000001 112.312 -178.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.494 ' HE1' ' HD2' ' A' ' 46' ' ' TYR . 65.7 t80 -77.84 114.75 17.0 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.719 -0.673 . . . . 74.450000000000003 111.555 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.7 m -97.39 -62.83 1.2 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.875 0.324 . . . . 64.329999999999998 111.875 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.21 171.08 20.85 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.465 0.543 . . . . 72.450000000000003 112.465 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -83.2 134.66 34.95 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.936 -0.574 . . . . 75.329999999999998 110.847 176.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -86.65 -58.74 2.49 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.646 0.26 . . . . 64.400000000000006 111.663 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 26' ' ' ARG . 31.4 ttm180 -172.65 137.14 0.78 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.115 0.413 . . . . 64.439999999999998 112.115 -178.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -94.83 109.06 21.08 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.316 -0.402 . . . . 73.310000000000002 110.066 172.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.0 m -77.81 120.74 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 121.12 0.486 . . . . 72.349999999999994 111.31 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.454 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 62.6 mtm180 -104.44 -178.46 3.66 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.403 0.621 . . . . 73.049999999999997 112.293 -174.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.507 HG12 ' HE2' ' A' ' 42' ' ' LYS . 52.8 mt -99.42 118.85 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.909 -0.587 . . . . 64.150000000000006 111.806 -175.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 53.9 tt0 -85.51 118.19 24.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.055 0.455 . . . . 64.040000000000006 110.825 175.042 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.9 m-20 -74.29 167.54 21.42 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.959 0.725 . . . . 71.340000000000003 112.959 -172.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.49 -11.38 60.64 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.849 -0.614 . . . . 70.319999999999993 111.065 176.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -68.69 -32.02 71.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.281 0.562 . . . . 72.019999999999996 110.788 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.09 -33.26 5.11 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 115.859 -0.609 . . . . 64.329999999999998 111.952 -174.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.8 p -81.28 158.88 24.63 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.087 0.47 . . . . 64.030000000000001 111.27 176.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 38.3 t -93.66 125.02 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 120.712 0.291 . . . . 72.0 111.78 -177.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.448 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 41.0 t -65.77 152.71 43.7 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.094 0.473 . . . . 73.209999999999994 111.407 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.454 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 6.0 m-20 -77.45 -1.87 32.47 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.154 0.502 . . . . 61.130000000000003 111.064 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.9 142.48 45.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.137 -0.483 . . . . 73.030000000000001 110.682 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.428 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 62.5 mt -108.27 143.47 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.066 0.46 . . . . 74.450000000000003 112.079 -173.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HE2' HG12 ' A' ' 30' ' ' ILE . 69.7 mmtt -88.29 -58.63 2.49 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.072 0.463 . . . . 71.040000000000006 110.616 171.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -145.06 171.47 14.44 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.013 -0.539 . . . . 72.439999999999998 111.078 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 44' ' ' ARG . 45.7 ttm105 -134.07 114.81 13.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.435 -0.348 . . . . 54.119999999999997 111.386 -176.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.1 m -97.47 128.41 44.22 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.491 0.552 . . . . 61.329999999999998 112.491 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.494 ' HD2' ' HE1' ' A' ' 21' ' ' PHE . 80.1 m-85 -110.68 158.05 19.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.24 0.616 . . . . 74.450000000000003 111.365 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -99.94 107.22 19.14 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.525 -0.307 . . . . 73.040000000000006 110.484 170.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.9 mt -109.63 121.78 45.98 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.79 0.329 . . . . 72.329999999999998 110.849 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -76.05 144.39 40.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.07 0.462 . . . . 71.329999999999998 111.376 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.636 ' HB3' ' HB3' ' A' ' 16' ' ' PHE . 34.2 m -128.85 152.18 48.8 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.075 -0.511 . . . . 72.510000000000005 111.222 -177.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -96.1 -178.92 4.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.967 0.413 . . . . 72.540000000000006 111.542 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -102.42 2.92 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.313 -0.47 . . . . 74.049999999999997 112.925 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -68.11 -29.79 68.8 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.042 0.386 . . . . 75.25 112.042 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.45 -3.84 40.12 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.516 -0.373 . . . . 51.140000000000001 113.2 -178.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 50' ' ' SER . 11.7 ptm180 -89.94 140.23 29.83 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 122.771 -0.252 . . . . 65.439999999999998 110.46 177.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -95.67 -179.55 4.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.978 0.418 . . . . 75.530000000000001 111.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.539 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 30.7 pt -126.65 138.11 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 116.266 -0.424 . . . . 74.340000000000003 111.194 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -102.46 107.72 18.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.717 -0.614 . . . . 73.209999999999994 110.86 176.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.629 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 97.9 t -100.38 125.46 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.8 0.667 . . . . 63.210000000000001 112.8 -172.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -108.05 127.78 54.09 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.039 0.447 . . . . 61.439999999999998 111.315 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.415 HD12 ' HB ' ' A' ' 65' ' ' VAL . 37.0 pt -113.58 151.98 45.01 Favored Pre-proline 0 N--CA 1.473 0.675 0 CA-C-N 116.465 -0.334 . . . . 74.140000000000001 111.0 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.6 154.4 73.94 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.195 1.93 . . . . 72.420000000000002 112.766 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.58 -18.81 8.33 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.363 0.505 . . . . 75.409999999999997 112.363 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.2 m -60.89 -19.67 60.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.795 0.438 . . . . 72.219999999999999 111.998 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 24.2 t -114.48 120.02 38.77 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 116.666 -0.243 . . . . 62.350000000000001 110.893 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 16.7 Cg_exo -68.49 -172.43 0.45 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.033 2.489 . . . . 74.0 113.799 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.6 tp -72.1 147.41 46.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.049 -0.523 . . . . 75.5 111.092 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.475 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.9 mptp? -94.89 111.82 23.58 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.028 0.442 . . . . 54.219999999999999 111.388 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -80.74 65.03 5.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.205 0.526 . . . . 53.140000000000001 111.061 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -98.22 166.85 11.2 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.636 0.731 . . . . 70.310000000000002 112.304 -177.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.467 ' HB3' ' HB2' ' A' ' 74' ' ' ALA . 24.8 t70 -74.53 149.05 40.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.299 -0.864 . . . . 71.239999999999995 111.462 178.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.2 122.62 16.59 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.023 0.439 . . . . 65.150000000000006 111.642 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 64.07 30.23 13.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.1 0.56 . . . . 73.129999999999995 111.89 -177.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 71' ' ' ASP . . . -80.59 151.33 29.14 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.719 0.295 . . . . 31.329999999999998 111.352 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -66.96 125.1 24.89 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.639 -0.255 . . . . 73.349999999999994 111.473 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.61 152.33 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 121.14 0.495 . . . . 64.439999999999998 112.007 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -137.69 169.52 17.64 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.858 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -107.79 155.02 20.69 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.714 0.769 . . . . 72.340000000000003 113.053 -174.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.5 mm -111.2 116.28 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 115.156 -0.929 . . . . 61.509999999999998 109.522 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.1 m120 53.84 75.46 0.62 Allowed Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 122.645 0.378 . . . . 74.0 111.917 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.58 130.82 7.07 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.68 2.253 . . . . 55.539999999999999 114.104 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 101' ' ' LYS . 48.7 pt -132.68 161.01 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.355 -0.384 . . . . 73.420000000000002 110.909 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.85 140.52 37.01 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.806 -0.558 . . . . 54.310000000000002 111.303 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.0 162.17 23.94 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 120.952 0.406 . . . . 74.310000000000002 110.989 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.434 ' HB ' ' HA ' ' A' ' 4' ' ' LEU . 16.5 m -117.88 1.35 12.08 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.109 0.411 . . . . 72.349999999999994 112.109 -176.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 4' ' ' LEU . 32.2 m -78.13 -175.27 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 121.909 -0.495 . . . . 64.430000000000007 111.581 177.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 67.65 7.52 5.72 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.085 0.469 . . . . 52.43 111.823 -179.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.3 t -89.42 10.49 22.39 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.211 0.529 . . . . 72.540000000000006 111.06 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.86 94.33 8.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.054 -0.521 . . . . 65.150000000000006 111.704 -178.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 95.1 m 76.12 -23.76 0.23 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.312 0.856 . . . . 73.109999999999999 113.312 172.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -67.94 157.66 34.52 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.276 0.56 . . . . 72.109999999999999 112.509 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -75.66 143.91 41.94 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.036 -0.529 . . . . 64.230000000000004 112.094 -178.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 94' ' ' ALA . . . -72.85 65.65 1.46 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.459 -0.337 . . . . 51.520000000000003 113.183 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 93' ' ' GLY . . . 169.96 -26.36 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.388 0.675 . . . . 61.509999999999998 110.799 -176.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.89 -33.58 64.08 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.909 0.707 . . . . 72.420000000000002 112.909 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.1 t -78.11 127.44 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 112.47 0.544 . . . . 72.230000000000004 112.47 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.04 122.92 18.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.586 -0.524 . . . . 75.329999999999998 109.586 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.539 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -70.83 129.24 38.56 Favored 'General case' 0 C--O 1.249 1.047 0 CA-C-O 122.538 1.161 . . . . 74.299999999999997 114.027 -168.069 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -95.72 113.02 24.62 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.031 -1.441 . . . . 75.420000000000002 111.512 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 9.9 mt -96.11 165.46 2.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.544 -0.909 . . . . 73.510000000000005 108.544 172.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HB2' HG13 ' A' ' 82' ' ' ILE . 28.5 mtpt -140.27 163.84 31.69 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.567 -0.708 . . . . 70.129999999999995 110.762 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -154.34 156.01 36.13 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.054 0.454 . . . . 62.130000000000003 111.87 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -74.94 -21.96 58.87 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.061 -0.518 . . . . 73.519999999999996 110.29 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -171.24 160.88 6.41 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.168 0.509 . . . . 54.210000000000001 111.482 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.475 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 38.5 mt -127.34 123.59 62.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.154 -0.475 . . . . 65.239999999999995 110.814 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.3 m -128.75 -179.43 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 122.411 0.284 . . . . 73.400000000000006 111.125 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 98.0 mt -78.41 144.17 36.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.757 0.313 . . . . 71.409999999999997 111.142 176.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.42 HG22 ' HG2' ' A' ' 110' ' ' GLU . 25.7 m -63.31 118.76 8.47 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.924 0.392 . . . . 61.409999999999997 111.407 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 71.8 mt -80.66 69.47 7.18 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.129 0.49 . . . . 62.240000000000002 111.981 -177.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.42 ' HG2' HG22 ' A' ' 108' ' ' THR . 63.2 mm-40 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 118.901 -0.571 . . . . 70.239999999999995 110.658 176.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 120.905 0.384 . . . . 65.209999999999994 111.5 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -73.38 124.96 26.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.967 0.413 . . . . 71.530000000000001 111.2 176.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.547 ' HD2' ' O ' ' A' ' 4' ' ' LEU . 6.4 tmm_? -95.32 112.24 23.98 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.902 0.382 . . . . 74.5 110.394 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.547 ' O ' ' HD2' ' A' ' 3' ' ' ARG . 2.8 mm? -80.4 -177.19 6.06 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.975 0.417 . . . . 71.200000000000003 111.937 -177.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.69 177.5 2.02 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.807 0.669 . . . . 65.140000000000001 112.807 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -73.62 169.22 17.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.862 -0.608 . . . . 73.329999999999998 112.013 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.12 -60.2 4.71 Favored Glycine 0 CA--C 1.525 0.689 0 CA-C-N 116.172 -0.467 . . . . 51.100000000000001 113.482 177.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.3 pt -72.92 155.36 7.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 121.143 0.497 . . . . 74.340000000000003 111.933 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.1 t -81.63 136.58 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 116.171 -0.468 . . . . 75.340000000000003 111.358 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.503 HD22 ' H ' ' A' ' 4' ' ' LEU . 72.0 mt -74.94 160.66 30.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.762 0.315 . . . . 64.200000000000003 111.141 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.32 110.68 1.72 Allowed 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.213 0.53 . . . . 70.430000000000007 111.909 -175.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -135.32 109.07 8.04 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.658 -0.701 . . . . 54.310000000000002 110.633 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 57.48 99.29 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.473 0.545 . . . . 63.350000000000001 112.473 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.1 p -101.91 108.83 20.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.088 0.471 . . . . 64.219999999999999 111.803 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.3 p -107.57 160.39 15.71 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.137 -0.483 . . . . 63.32 110.939 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -80.66 106.33 12.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.73 0.3 . . . . 73.109999999999999 110.996 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.71 -99.63 1.08 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.346 -0.454 . . . . 23.41 113.507 -178.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.551 ' HG2' HG21 ' A' ' 108' ' ' THR . 51.5 mt-10 -104.0 121.12 42.51 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.542 -0.387 . . . . 64.129999999999995 111.49 -178.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -100.06 157.03 16.84 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.495 -0.32 . . . . 75.209999999999994 110.303 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -123.23 114.73 20.65 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.844 -0.535 . . . . 74.329999999999998 111.607 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -63.75 132.12 49.99 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.258 0.466 . . . . 71.120000000000005 112.258 -176.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.9 t -109.15 -65.01 1.18 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.131 0.419 . . . . 73.329999999999998 112.131 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.49 173.68 15.21 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.117 0.484 . . . . 63.210000000000001 112.06 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.2 tp -88.37 117.28 27.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.318 -0.401 . . . . 74.25 110.411 173.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -72.69 -62.38 1.47 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.969 0.414 . . . . 74.129999999999995 112.026 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -170.1 143.7 2.52 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.058 -0.519 . . . . 64.109999999999999 111.562 -175.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.0 mt-10 -105.23 103.66 13.24 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.375 -0.602 . . . . 65.510000000000005 109.375 170.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.537 HG23 ' HB2' ' A' ' 42' ' ' LYS . 15.9 m -67.25 102.03 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.587 0.708 . . . . 71.099999999999994 110.876 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 98.9 mtt180 -98.52 158.31 15.68 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.719 0.637 . . . . 70.010000000000005 112.719 -171.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.5 mt -69.02 109.3 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.586 -0.733 . . . . 70.200000000000003 112.076 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.0 tt0 -86.85 124.52 33.17 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.904 0.383 . . . . 73.109999999999999 110.332 174.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -70.43 155.44 40.69 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.795 0.331 . . . . 73.409999999999997 111.728 -178.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -23.71 62.72 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.407 0.623 . . . . 74.310000000000002 110.666 169.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.1 -28.06 64.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.652 -0.704 . . . . 71.040000000000006 111.499 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.81 -36.6 4.02 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 116.26 -0.427 . . . . 50.32 112.456 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.3 p -71.33 150.64 44.92 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 50.200000000000003 111.817 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 22.8 t -92.37 145.92 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.158 -0.474 . . . . 65.319999999999993 111.078 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.2 t -101.7 163.4 12.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.111 0.482 . . . . 62.43 111.835 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -77.54 -18.1 57.3 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.986 -0.552 . . . . 64.230000000000004 111.141 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.72 132.1 45.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.279 -0.419 . . . . 73.040000000000006 110.086 173.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 26.2 mt -109.84 147.47 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 112.069 0.396 . . . . 52.109999999999999 112.069 -169.103 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HB2' HG23 ' A' ' 28' ' ' VAL . 39.7 mmtm -74.56 -61.06 2.0 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.416 -0.587 . . . . 61.140000000000001 109.416 169.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -155.26 167.23 31.05 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.384 -0.825 . . . . 63.350000000000001 110.022 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.462 ' HD3' ' OH ' ' A' ' 46' ' ' TYR . 4.3 ptp85 -122.7 133.72 54.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.161 0.505 . . . . 73.319999999999993 112.157 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.5 m -107.52 124.93 50.63 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.858 -0.61 . . . . 74.150000000000006 112.474 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.462 ' OH ' ' HD3' ' A' ' 44' ' ' ARG . 79.7 m-85 -110.81 153.66 25.05 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 122.88 0.472 . . . . 74.239999999999995 111.143 176.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.64 114.33 26.25 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.324 -0.398 . . . . 72.129999999999995 111.06 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.543 HD12 HG21 ' A' ' 59' ' ' VAL . 47.4 mt -114.21 132.34 56.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.569 0.7 . . . . 73.5 111.77 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 49' ' ' LYS . 2.6 mmmp? -93.28 150.99 20.07 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.557 -0.747 . . . . 73.200000000000003 111.16 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.424 ' HB3' HE22 ' A' ' 53' ' ' GLN . 64.2 m -115.6 120.2 38.65 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.871 0.367 . . . . 70.040000000000006 111.802 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -73.47 121.33 20.38 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.089 -0.505 . . . . 71.430000000000007 110.753 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.49 -102.9 0.65 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.085 -0.579 . . . . 72.140000000000001 113.825 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 55' ' ' ARG . 5.5 pm0 -64.2 -11.52 31.74 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.114 0.783 . . . . 75.230000000000004 113.114 -175.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.83 16.59 72.36 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.728 -0.749 . . . . 70.239999999999995 114.316 175.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HB2' HE21 ' A' ' 53' ' ' GLN . 36.9 mtt180 -78.89 161.95 26.37 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 117.455 0.628 . . . . 75.219999999999999 111.119 174.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.9 ttt -128.43 148.63 50.72 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.975 -0.557 . . . . 65.109999999999999 110.763 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 pt -135.48 135.44 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.918 0.389 . . . . 73.349999999999994 111.28 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -98.11 105.73 17.92 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.109 0.48 . . . . 52.409999999999997 110.494 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.543 HG21 HD12 ' A' ' 48' ' ' LEU . 70.1 t -94.41 129.98 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.343 -0.389 . . . . 73.329999999999998 111.715 -174.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.5 ' O ' ' HA ' ' A' ' 101' ' ' LYS . 39.9 m -118.38 141.82 48.15 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.944 0.402 . . . . 73.549999999999997 111.292 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.1 pt -131.24 150.97 78.0 Favored Pre-proline 0 CA--C 1.539 0.525 0 O-C-N 122.305 -0.247 . . . . 72.299999999999997 110.928 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HG2' HG23 ' A' ' 65' ' ' VAL . 12.2 Cg_endo -55.76 146.13 68.09 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.481 2.12 . . . . 73.200000000000003 112.974 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.49 -28.49 59.94 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.678 0.621 . . . . 43.25 112.678 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.0 m -62.23 -26.5 68.41 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.079 0.4 . . . . 63.409999999999997 112.079 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.471 HG23 ' HG2' ' A' ' 62' ' ' PRO . 51.0 t -79.01 125.05 84.48 Favored Pre-proline 0 CA--C 1.544 0.723 0 CA-C-N 116.841 -0.163 . . . . 52.0 110.996 179.161 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -64.73 161.35 36.3 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.408 . . . . 73.200000000000003 114.416 -174.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.7 tp -67.61 138.16 56.19 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.835 -0.621 . . . . 73.040000000000006 111.224 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.4 mptp? -81.84 -48.98 10.89 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.266 0.839 . . . . 74.420000000000002 113.266 -173.695 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 63.77 21.59 12.73 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.834 0.679 . . . . 73.129999999999995 112.834 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -64.66 159.5 21.9 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.009 0.433 . . . . 61.219999999999999 111.865 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 4.9 m-20 -68.06 154.22 42.1 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.409 0.623 . . . . 72.109999999999999 112.512 -177.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -65.02 133.53 51.88 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.718 -0.673 . . . . 73.040000000000006 111.178 174.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 63.3 19.54 11.74 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.189 0.596 . . . . 73.099999999999994 112.481 -177.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -82.22 153.65 25.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.156 0.428 . . . . 50.210000000000001 112.156 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.529 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 65.4 mtt85 -70.77 104.35 2.86 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.954 -0.566 . . . . 33.210000000000001 112.111 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.443 HG12 HD23 ' A' ' 107' ' ' LEU . 31.8 m -120.13 153.06 23.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.099 -0.5 . . . . 75.129999999999995 111.273 177.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -145.92 173.49 12.1 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.131 0.491 . . . . 73.439999999999998 111.064 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HG11 ' A' ' 59' ' ' VAL . 81.8 mt -112.18 132.17 55.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.061 0.457 . . . . 52.329999999999998 111.981 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.449 HG22 ' OD1' ' A' ' 80' ' ' ASN . 48.5 mm -65.04 -59.54 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 115.916 -0.584 . . . . 64.230000000000004 111.337 178.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.569 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 23.2 m120 -130.41 87.41 50.53 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 122.388 -0.195 . . . . 75.420000000000002 110.936 174.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.34 140.4 10.87 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.219 2.612 . . . . 64.219999999999999 114.509 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.8 pt -136.11 149.57 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 120.828 0.347 . . . . 54.130000000000003 110.858 172.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.35 117.36 29.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.579 0.228 . . . . 64.540000000000006 111.097 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.59 141.59 41.9 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.527 0.936 . . . . 72.530000000000001 113.527 -173.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.9 t -130.83 20.33 5.03 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.834 -1.076 . . . . 74.230000000000004 109.512 170.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.1 m -75.48 9.42 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 113.226 0.824 . . . . 70.030000000000001 113.226 -173.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.542 ' HB1' ' HB2' ' A' ' 91' ' ' TYR . . . -79.27 53.85 1.57 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.404 0.621 . . . . 74.340000000000003 111.031 177.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.7 p -79.79 -18.39 51.1 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.908 -0.587 . . . . 75.099999999999994 112.326 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -89.54 92.85 9.27 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.887 0.375 . . . . 70.519999999999996 111.655 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.5 m 80.3 -29.99 0.13 Allowed 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.645 0.778 . . . . 62.119999999999997 113.038 174.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.542 ' HB2' ' HB1' ' A' ' 87' ' ' ALA . 97.0 m-85 -80.11 19.27 0.74 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.341 0.867 . . . . 75.019999999999996 113.341 -175.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -53.89 137.12 39.56 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.928 0.394 . . . . 43.119999999999997 111.458 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 105.74 62.92 0.62 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 121.229 -0.51 . . . . 73.540000000000006 113.287 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -124.5 76.57 1.5 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.189 0.519 . . . . 74.430000000000007 111.235 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -86.89 110.65 20.13 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.156 -0.475 . . . . 62.299999999999997 111.012 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.5 t 70.98 -51.58 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 123.429 0.692 . . . . 62.549999999999997 112.217 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -58.99 104.68 0.25 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.939 -0.393 . . . . 74.340000000000003 109.939 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -133.43 165.01 25.86 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.537 0.94 . . . . 73.209999999999994 113.537 -166.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.03 148.41 41.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.954 -1.021 . . . . 71.439999999999998 111.64 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 65.1 mt -129.01 115.04 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.106 -0.497 . . . . 52.32 110.24 177.073 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 60' ' ' SER . 45.7 mtpt -89.98 136.14 33.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 64.310000000000002 111.813 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.13 153.29 43.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.339 0.59 . . . . 71.430000000000007 112.068 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.6 t70 -63.94 -40.66 96.95 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.309 0.576 . . . . 72.140000000000001 111.028 173.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -165.22 158.49 16.5 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.742 -0.663 . . . . 72.530000000000001 111.112 179.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.445 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 39.2 mt -119.01 123.23 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.136 -0.484 . . . . 53.140000000000001 111.25 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 36.0 m -128.12 -179.8 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 120.781 0.324 . . . . 64.129999999999995 111.75 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.443 HD23 HG12 ' A' ' 76' ' ' VAL . 87.5 mt -91.58 138.16 31.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 73.409999999999997 111.435 177.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.551 HG21 ' HG2' ' A' ' 18' ' ' GLU . 8.3 m -75.71 153.72 36.9 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.046 -0.525 . . . . 53.240000000000002 111.452 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt 64.85 33.15 10.32 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.705 0.631 . . . . 61.210000000000001 112.705 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 . . . . . 0 C--O 1.255 1.346 0 CA-C-O 118.94 -0.552 . . . . 72.150000000000006 110.716 174.433 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 93.4 mt . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 109.598 -0.519 . . . . 72.33 109.598 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.567 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 59.1 mtmt -124.26 134.8 53.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.255 0.55 . . . . 73.43 111.689 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.79 144.36 57.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.404 -0.816 . . . . 73.53 113.012 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 71.7 m -123.55 -62.43 1.31 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.132 -0.485 . . . . 74.33 111.33 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.16 179.68 8.8 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.161 0.505 . . . . 50.24 111.916 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.2 tp -101.94 101.32 11.72 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.485 -0.561 . . . . 63.32 109.485 170.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HG2' ' OE1' ' A' ' 58' ' ' GLN . 10.4 tpp180 -58.3 -58.82 6.8 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.225 0.454 . . . . 71.12 112.225 -173.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -169.14 135.21 1.67 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.84 0.353 . . . . 74.11 111.73 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -98.82 98.14 9.27 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 110.006 -0.368 . . . . 70.42 110.006 174.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.49 135.84 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.805 0.336 . . . . 51.31 110.75 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.464 ' HG2' HD13 ' A' ' 41' ' ' ILE . 80.7 mtt180 -116.68 170.25 8.73 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.476 0.655 . . . . 74.23 112.742 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -75.1 113.65 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 115.577 -0.738 . . . . 73.14 111.385 -175.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -83.56 133.83 34.85 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.934 0.397 . . . . 63.4 111.932 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -80.6 150.25 29.58 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.544 -0.298 . . . . 61.43 110.858 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.22 -34.67 70.66 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.866 0.365 . . . . 65.51 111.97 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.53 -27.62 66.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.302 -0.408 . . . . 74.11 111.975 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.26 -57.52 0.64 Allowed Glycine 0 CA--C 1.524 0.64 0 C-N-CA 120.827 -0.701 . . . . 53.01 113.042 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.1 m -62.96 149.79 43.87 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.428 0.633 . . . . 72.14 112.375 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 39.5 t -90.94 147.55 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.979 -0.555 . . . . 72.32 111.228 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -81.31 174.54 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.574 0.702 . . . . 72.25 112.123 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -88.23 -10.4 49.87 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.535 -0.757 . . . . 72.13 111.225 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 29' ' ' ARG . 21.9 mm-40 -81.89 144.04 31.25 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.125 0.488 . . . . 71.23 111.871 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.464 HD13 ' HG2' ' A' ' 29' ' ' ARG . 20.7 mm -85.08 153.43 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.945 -0.571 . . . . 53.25 112.323 -172.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -113.9 -58.17 2.18 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 116.343 -0.39 . . . . 72.54 110.107 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -141.13 160.46 40.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.051 0.54 . . . . 72.45 110.825 172.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 44' ' ' ARG . 37.7 mtt180 -119.05 117.46 28.82 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.595 0.236 . . . . 75.45 110.899 178.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.0 m -96.2 121.35 37.89 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 111.91 0.337 . . . . 54.35 111.91 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.407 ' OH ' HD12 ' A' ' 67' ' ' LEU . 55.8 m-85 -108.47 153.92 22.64 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.235 0.541 . . . . 72.32 112.021 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -97.0 112.58 24.27 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.757 -0.656 . . . . 74.55 110.716 174.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.654 HD12 HG21 ' A' ' 59' ' ' VAL . 81.4 mt -123.66 137.42 54.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.691 0.282 . . . . 71.53 111.19 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.52 140.46 32.73 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.763 0.316 . . . . 72.24 110.418 174.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.468 0.425 0 CA-C-O 121.131 0.491 . . . . 73.12 111.486 -179.085 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 112.296 0.48 . . . . 73.5 112.296 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.4 ptp -72.92 118.69 16.17 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.234 -0.439 . . . . 72.51 109.983 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.9 pt -94.74 138.08 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-O 120.996 0.426 . . . . 71.41 111.947 -173.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.495 ' OE1' ' HG2' ' A' ' 25' ' ' ARG . 25.2 mm-40 -93.16 104.71 16.88 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.24 -0.436 . . . . 75.55 110.977 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.654 HG21 HD12 ' A' ' 48' ' ' LEU . 81.0 t -98.49 116.16 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-O 120.875 0.369 . . . . 73.23 111.481 -177.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.9 t -111.06 123.93 51.16 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.872 0.368 . . . . 43.11 111.697 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.401 HD12 ' CG1' ' A' ' 65' ' ' VAL . 32.0 pt -115.31 147.06 37.79 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.328 -0.396 . . . . 70.05 110.944 176.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.95 157.61 51.83 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 122.325 2.017 . . . . 70.05 113.698 -177.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.01 -33.27 66.99 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.879 0.696 . . . . 61.24 112.879 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 58.4 m -58.32 -19.42 34.83 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.737 0.303 . . . . 45.23 111.721 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG1' HD12 ' A' ' 61' ' ' ILE . 43.9 t -91.31 126.07 56.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-N 116.545 -0.298 . . . . 73.21 110.829 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.78 162.1 43.38 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.406 2.07 . . . . 71.42 113.149 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.407 HD12 ' OH ' ' A' ' 46' ' ' TYR . 52.6 tp -72.42 142.33 48.67 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.202 -0.454 . . . . 75.53 111.183 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.02 106.72 15.89 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.259 0.552 . . . . 74.33 111.475 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -74.79 74.87 2.1 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.72 -0.673 . . . . 74.11 111.568 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -94.67 154.43 17.33 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.967 0.413 . . . . 65.54 112.009 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.3 170.47 16.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.005 0.431 . . . . 63.45 111.671 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -67.75 129.95 41.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.043 0.449 . . . . 62.34 111.687 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.567 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 90.3 m-20 69.42 18.31 7.91 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.604 0.762 . . . . 64.11 113.028 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.38 132.66 52.2 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.193 -0.317 . . . . 73.12 110.958 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.1 mtm180 -76.36 118.67 19.3 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.025 0.44 . . . . 65.32 111.932 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.563 HG12 HD23 ' A' ' 107' ' ' LEU . 34.0 m -124.75 161.38 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.999 -0.546 . . . . 71.52 111.489 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -138.49 147.23 42.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.125 0.488 . . . . 72.21 110.311 171.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.9 mt -97.81 137.49 36.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.308 -0.405 . . . . 60.04 112.035 -173.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.5 mm -63.57 -71.16 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 CA-C-N 116.12 -0.491 . . . . 75.21 111.413 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.477 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 92.4 m-20 -122.75 82.96 48.95 Favored Pre-proline 0 N--CA 1.473 0.694 0 CA-C-O 120.667 0.27 . . . . 64.23 111.438 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -82.43 132.2 6.81 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.977 2.451 . . . . 73.44 113.574 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.5 pt -136.91 125.71 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 120.858 0.361 . . . . 73.13 111.492 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.02 114.11 18.68 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.302 -0.259 . . . . 41.21 110.302 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 121.604 0.716 . . . . 60.1 112.495 -170.489 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 . . . . . 0 CA--C 1.543 0.682 0 CA-C-O 121.253 0.549 . . . . 63.52 112.329 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -107.48 137.85 44.77 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.622 0.725 . . . . 65.03 112.318 -171.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 52.7 mt -126.68 109.16 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.567 -0.742 . . . . 71.54 110.716 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -82.73 129.2 34.93 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 122.138 -0.351 . . . . 73.54 110.493 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.9 167.39 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.289 0.566 . . . . 61.52 112.355 -174.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.477 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 31.3 t70 -86.68 -62.04 1.6 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.763 -0.653 . . . . 64.42 111.235 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -145.59 155.03 42.79 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.127 0.489 . . . . 71.02 111.122 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 71.0 mt -111.81 115.07 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 115.734 -0.666 . . . . 60.42 111.577 -178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.32 172.23 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 120.549 0.214 . . . . 65.25 111.055 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.563 HD23 HG12 ' A' ' 76' ' ' VAL . 96.2 mt -83.15 150.0 26.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 122.284 -0.26 . . . . 74.32 110.892 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.1 m . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 120.762 0.315 . . . . 75.4 111.345 -179.233 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 57' ' ' ILE . 55.4 mt . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 120.957 0.408 . . . . 64.5 111.965 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.578 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 11.1 mptt -116.62 115.67 26.14 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.855 0.36 . . . . 71.3 111.506 178.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.402 ' HA ' HD23 ' A' ' 48' ' ' LEU . 91.1 t80 -66.8 126.77 30.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.231 -0.44 . . . . 72.44 111.154 177.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.559 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 82.0 p -106.83 -63.51 1.27 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.949 0.351 . . . . 72.4 111.949 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.92 176.61 12.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.345 0.593 . . . . 52.1 112.087 -177.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.44 HD21 ' HG3' ' A' ' 27' ' ' GLU . 61.1 tp -83.16 117.81 23.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.985 -0.552 . . . . 65.31 111.101 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -69.07 -66.81 0.53 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.939 0.399 . . . . 75.44 111.363 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -168.25 131.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.061 0.458 . . . . 73.12 111.745 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.44 ' HG3' HD21 ' A' ' 24' ' ' LEU . 47.2 mt-10 -96.8 99.37 10.95 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.315 -0.402 . . . . 64.53 110.058 173.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m -74.34 118.98 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.281 0.562 . . . . 73.25 111.516 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.638 ' HG2' HG12 ' A' ' 41' ' ' ILE . 96.3 mtt180 -96.54 164.36 12.64 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.443 0.64 . . . . 71.5 112.291 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.88 111.19 13.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 115.793 -0.64 . . . . 71.53 111.041 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.5 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 61.6 tt0 -82.75 147.11 28.62 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.053 0.454 . . . . 75.13 111.617 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -90.93 166.94 12.78 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.924 0.392 . . . . 64.23 110.477 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.39 -24.73 57.25 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 122.131 -0.356 . . . . 74.53 111.678 -178.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -80.91 32.27 0.32 Allowed 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 111.965 0.357 . . . . 71.24 111.965 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.45 -48.08 3.75 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 114.182 0.433 . . . . 71.21 114.182 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 m -66.79 145.3 55.65 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.236 0.541 . . . . 72.15 112.428 -177.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.5 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.5 t -96.29 140.65 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.018 -0.537 . . . . 75.32 111.161 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -75.65 171.68 13.9 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.313 0.578 . . . . 71.34 111.293 178.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.3 -18.3 32.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 53.14 110.707 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.38 137.62 57.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.624 -0.716 . . . . 55.12 110.603 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.638 HG12 ' HG2' ' A' ' 29' ' ' ARG . 32.4 mt -104.46 142.57 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 121.179 0.514 . . . . 75.44 111.377 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.55 -57.78 2.38 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.274 -0.421 . . . . 72.33 111.043 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' OG ' ' A' ' 60' ' ' SER . 61.7 mt-10 -137.46 148.48 46.13 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 120.992 0.425 . . . . 73.22 111.688 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -110.2 111.58 23.0 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.357 -0.383 . . . . 73.14 111.166 176.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.4 m -101.46 124.16 46.69 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.393 0.516 . . . . 72.15 112.393 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.2 m-85 -115.83 160.58 19.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.905 0.482 . . . . 72.31 111.045 177.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -101.12 125.61 47.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.714 0.292 . . . . 43.4 111.67 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.57 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -123.52 134.37 53.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-O 120.795 0.331 . . . . 71.11 111.722 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HE2' ' HB3' ' A' ' 22' ' ' SER . 3.8 mptp? -80.77 147.25 30.59 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.98 0.419 . . . . 74.23 111.313 173.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 116.083 -0.508 . . . . 72.42 110.507 174.234 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 55' ' ' ARG . 5.3 ptp180 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 120.975 0.417 . . . . 72.51 111.933 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 43.1 ttm -96.88 110.43 22.94 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.133 -0.485 . . . . 74.11 109.701 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.432 HD11 HD13 ' A' ' 19' ' ' LEU . 26.8 pt -95.1 127.97 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 121.026 0.441 . . . . 73.14 111.176 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.448 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 77.3 mt-30 -93.65 105.82 17.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.378 0.608 . . . . 71.03 110.656 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.57 HG21 HD12 ' A' ' 48' ' ' LEU . 84.0 t -94.82 122.53 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 115.988 -0.551 . . . . 74.55 111.986 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.729 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 24.5 t -114.35 130.21 56.67 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.968 0.413 . . . . 75.34 111.377 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 pt -120.36 156.2 55.54 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 116.315 -0.402 . . . . 71.55 110.982 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.35 125.75 19.44 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.452 2.101 . . . . 61.31 112.392 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.5 39.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.016 0.747 . . . . 73.41 113.016 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.0 t -56.82 -30.76 64.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.058 0.456 . . . . 54.13 111.519 175.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.4 t -78.75 133.88 61.75 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 116.069 -0.514 . . . . 72.24 111.328 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.49 158.01 4.41 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.379 2.719 . . . . 75.52 114.476 -178.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.447 HD12 ' OH ' ' A' ' 46' ' ' TYR . 58.6 tp -68.14 145.81 54.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.254 -0.885 . . . . 61.55 111.767 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -90.12 126.03 35.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.254 0.549 . . . . 63.42 111.88 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -107.65 25.78 11.09 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.661 -0.7 . . . . 73.22 111.592 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -62.19 153.45 30.3 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.208 0.528 . . . . 75.21 112.087 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -80.97 164.71 22.35 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.894 -0.594 . . . . 33.12 112.267 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -59.12 118.08 5.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.065 -0.516 . . . . 71.45 111.614 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.526 HD22 ' N ' ' A' ' 73' ' ' ASN . 0.8 OUTLIER 68.31 24.25 7.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.55 0.74 . . . . 73.42 112.216 -178.639 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.79 133.92 50.06 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.765 0.317 . . . . 73.53 111.3 176.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.578 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 75.5 mtm180 -74.63 113.49 11.95 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.116 0.484 . . . . 73.33 111.682 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.16 153.99 35.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.284 0.564 . . . . 73.31 111.999 -177.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.4 pt-20 -128.01 154.72 45.31 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.268 173.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.35 146.67 24.54 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.168 0.803 . . . . 71.41 113.168 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.72 112.49 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 115.336 -0.847 . . . . 62.4 110.036 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 58.78 62.01 4.59 Favored Pre-proline 0 CA--C 1.547 0.864 0 N-CA-C 112.023 0.379 . . . . 62.14 112.023 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -81.66 140.45 11.75 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.817 2.345 . . . . 75.1 113.8 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.44 147.23 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-O 120.945 0.402 . . . . 55.55 111.099 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.35 108.16 16.35 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.916 0.389 . . . . 72.03 110.693 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 121.214 0.53 . . . . 61.25 111.564 -174.851 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.244 0.789 0 N-CA-C 114.352 1.241 . . . . 74.13 114.352 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.448 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -104.39 120.75 41.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.406 -1.27 . . . . 75.13 111.818 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.489 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 56.4 mt -99.59 107.18 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.219 -0.446 . . . . 74.31 109.968 175.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.729 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 58.7 mtpt -94.06 129.14 40.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.15 0.5 . . . . 73.33 111.942 -175.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.48 174.7 7.62 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.991 0.425 . . . . 71.42 111.467 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.23 -37.05 26.56 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.952 0.406 . . . . 71.2 110.787 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -161.01 164.93 30.6 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 116.316 -0.402 . . . . 73.32 111.502 177.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 44.2 mt -122.56 118.39 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 116.494 -0.321 . . . . 73.35 110.815 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.38 167.13 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 120.793 0.33 . . . . 74.11 111.652 -177.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -70.74 144.13 51.03 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.649 0.262 . . . . 71.23 111.123 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.414 ' HA ' ' HG2' ' A' ' 77' ' ' GLU . 57.8 m . . . . . 0 N--CA 1.473 0.689 0 CA-C-O 120.837 0.351 . . . . 64.01 111.881 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 CA--C 1.533 0.321 0 CA-C-O 120.813 0.34 . . . . 75.31 110.174 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 56.9 mtmt -123.71 117.22 24.45 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.258 0.551 . . . . 72.3 111.978 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.7 157.46 9.35 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.948 -1.024 . . . . 73.11 113.03 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.48 ' OG ' ' HE3' ' A' ' 49' ' ' LYS . 33.9 m -134.14 -65.22 0.66 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.208 0.448 . . . . 63.22 112.208 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.52 -179.29 7.53 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.222 0.534 . . . . 42.11 112.307 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.437 HD21 ' HG3' ' A' ' 27' ' ' GLU . 59.0 tp -88.29 120.08 29.32 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.833 -0.621 . . . . 40.5 110.308 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -76.37 -55.31 5.66 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.982 0.42 . . . . 74.42 111.421 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -173.57 131.74 0.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.141 -0.482 . . . . 75.42 111.003 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG3' HD21 ' A' ' 24' ' ' LEU . 37.7 mt-10 -90.83 98.63 11.89 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.721 -0.474 . . . . 60.42 109.721 171.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.4 m -67.27 119.22 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.33 0.586 . . . . 74.44 111.284 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.519 ' HG2' HG12 ' A' ' 41' ' ' ILE . 56.5 mtt180 -98.48 167.91 10.52 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.378 0.609 . . . . 63.41 112.081 -175.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -83.07 100.22 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.842 -0.617 . . . . 74.24 112.041 -172.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 60.9 tt0 -79.41 120.74 24.26 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.482 -0.326 . . . . 75.34 110.961 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -67.46 153.34 43.91 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.379 0.511 . . . . 75.21 112.379 -174.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.02 -32.37 67.89 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.565 0.697 . . . . 61.14 110.702 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.24 -27.77 66.08 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.225 -0.898 . . . . 62.11 112.002 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.55 -42.15 1.52 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 121.383 -0.437 . . . . 73.44 112.737 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -75.85 151.62 37.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.063 0.459 . . . . 74.14 111.702 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 36.9 t -88.13 136.86 22.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.411 -0.359 . . . . 72.11 111.414 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t -84.83 149.89 25.4 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.765 0.317 . . . . 63.43 110.539 174.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.05 -14.79 61.48 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.131 0.419 . . . . 33.53 112.131 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.28 142.2 58.5 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.936 0.398 . . . . 64.14 111.333 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.519 HG12 ' HG2' ' A' ' 29' ' ' ARG . 43.9 mt -100.58 139.07 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.501 -0.318 . . . . 75.11 110.696 -178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.61 -58.29 2.23 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.776 0.322 . . . . 74.13 111.121 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.42 159.38 42.29 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.135 0.493 . . . . 73.11 111.505 177.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 37.2 mtt-85 -115.62 116.89 28.89 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.264 -0.425 . . . . 62.52 110.67 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 m -92.49 129.09 38.52 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.655 0.243 . . . . 44.33 111.655 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.468 ' OH ' HD12 ' A' ' 67' ' ' LEU . 49.6 m-85 -116.77 156.52 27.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.679 0.392 . . . . 72.42 111.442 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -100.18 112.78 25.1 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.166 -0.47 . . . . 75.33 111.061 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 59' ' ' VAL . 42.2 mt -114.93 149.01 37.93 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 122.292 -0.255 . . . . 74.54 110.788 177.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.543 ' NZ ' ' HB2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -103.83 141.55 35.93 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 122.043 -0.411 . . . . 73.42 111.469 173.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.469 0.486 0 CA-C-N 116.073 -0.512 . . . . 72.23 110.743 176.596 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 112.282 0.475 . . . . 73.44 112.282 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.566 ' N ' ' SD ' ' A' ' 56' ' ' MET . 1.2 mpt? -79.13 157.94 27.84 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.319 0.859 . . . . 73.33 113.319 -173.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.1 pt -142.03 135.02 28.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.01 -0.995 . . . . 64.14 109.586 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.446 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 24.0 mp0 -93.15 104.35 16.55 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.159 0.504 . . . . 72.54 111.574 -178.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -96.94 130.02 46.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 116.378 -0.373 . . . . 54.1 111.419 -177.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m -119.15 129.26 54.92 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.682 0.277 . . . . 71.11 111.434 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.403 HG12 ' HE1' ' A' ' 46' ' ' TYR . 25.9 pt -123.23 149.6 57.99 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.584 -0.28 . . . . 63.41 110.575 176.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.73 139.62 39.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.557 2.171 . . . . 71.25 113.226 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.2 -26.32 67.64 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 112.585 0.587 . . . . 73.02 112.585 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.4 t -63.8 -30.28 71.39 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.03 0.443 . . . . 64.4 111.3 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.0 t -72.18 130.41 86.38 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.216 -0.447 . . . . 72.24 110.708 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -43.66 131.88 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 123.175 2.584 . . . . 74.15 114.323 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.468 HD12 ' OH ' ' A' ' 46' ' ' TYR . 62.0 tp -58.37 137.68 57.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.996 -0.547 . . . . 72.31 111.201 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -75.05 125.95 30.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.198 0.523 . . . . 73.33 111.255 177.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -118.01 22.43 12.24 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.849 -0.614 . . . . 61.43 111.384 -175.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.419 ' CE2' ' HG3' ' A' ' 68' ' ' LYS . 26.0 m-85 -69.34 172.29 7.31 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.522 0.564 . . . . 64.41 112.522 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.43 174.93 8.66 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.879 -0.6 . . . . 72.32 111.576 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -74.21 135.66 42.76 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 110.012 -0.366 . . . . 61.22 110.012 176.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 95.0 m-20 60.56 20.97 10.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.799 0.44 . . . . 74.55 112.105 -174.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . -68.13 139.9 56.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.926 0.393 . . . . 70.1 111.663 178.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.601 ' HG3' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -68.1 111.13 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.073 -0.512 . . . . 74.21 111.145 179.342 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.9 m -129.41 147.92 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.362 0.601 . . . . 74.25 112.133 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -133.16 151.2 51.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.025 -0.534 . . . . 72.3 110.727 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -99.95 135.48 41.32 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.301 -0.409 . . . . 63.14 111.768 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.442 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.8 mp -67.77 -76.01 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.386 -0.37 . . . . 63.44 111.061 177.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -126.7 85.36 60.8 Favored Pre-proline 0 N--CA 1.472 0.648 0 CA-C-O 120.754 0.312 . . . . 73.45 110.951 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.27 156.19 14.63 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 123.219 2.613 . . . . 50.33 114.469 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.4 pt -142.81 123.11 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.82 -0.627 . . . . 75.54 110.32 171.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.0 126.88 30.87 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.354 -0.216 . . . . 64.15 110.929 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 CA--C 1.538 0.492 0 CA-C-O 121.193 0.52 . . . . 62.42 111.271 -179.433 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 121.984 0.897 . . . . 65.21 113.309 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 37.6 m-85 -106.57 149.49 27.11 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.861 -1.063 . . . . 74.11 111.683 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.3 mt -130.37 108.02 15.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 116.227 -0.442 . . . . 74.13 110.311 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -77.99 129.25 35.06 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 122.295 -0.253 . . . . 72.14 111.139 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -130.65 151.71 50.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.29 0.478 . . . . 73.0 112.29 -176.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.1 -39.88 93.98 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.18 -0.464 . . . . 63.14 111.436 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -172.39 162.3 5.38 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.207 -0.451 . . . . 73.22 111.092 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.412 HG12 ' CD2' ' A' ' 78' ' ' LEU . 31.2 mt -122.42 117.43 52.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 115.938 -0.573 . . . . 72.53 110.839 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.9 m -122.34 -179.33 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.21 0.204 . . . . 74.2 111.232 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 88.4 mt -77.85 147.55 35.09 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 120.952 0.406 . . . . 74.3 111.943 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 112.358 0.503 . . . . 32.33 112.358 -177.254 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 N--CA 1.469 0.506 0 CA-C-O 121.344 0.592 . . . . 75.31 112.263 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.569 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 47.4 mmtm -123.97 121.86 36.4 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 55.31 111.456 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -66.75 102.04 0.89 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.818 0.342 . . . . 74.2 110.581 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 21.9 t -89.61 -63.59 1.26 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 111.972 0.36 . . . . 60.21 111.972 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.29 -178.52 7.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.288 0.477 . . . . 62.11 112.288 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.6 tp -89.35 118.03 28.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.941 0.4 . . . . 62.15 110.896 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.8 -64.48 1.03 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.958 0.409 . . . . 75.41 111.748 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -164.71 136.85 4.52 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.36 -0.382 . . . . 75.22 111.335 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -97.9 101.46 12.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.803 0.335 . . . . 74.43 110.243 173.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' HB2' ' A' ' 42' ' ' LYS . 18.3 m -72.2 98.75 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 121.657 0.741 . . . . 64.14 111.327 -178.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 41' ' ' ILE . 85.6 mtt-85 -89.64 155.66 19.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.881 -0.6 . . . . 70.31 111.611 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.595 HG12 ' HE3' ' A' ' 42' ' ' LYS . 56.7 mt -68.85 106.66 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.995 -0.548 . . . . 71.34 111.258 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -85.61 123.93 31.58 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.839 0.352 . . . . 73.11 110.925 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -66.35 157.19 32.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.31 -0.405 . . . . 74.22 111.714 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -62.46 -25.84 68.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.077 0.465 . . . . 75.4 110.99 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -63.87 -15.84 59.92 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 116.021 -0.536 . . . . 74.4 111.611 175.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 -18.46 40.91 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.399 -0.364 . . . . 44.21 112.866 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.4 p -77.8 157.49 29.93 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.14 0.495 . . . . 70.43 111.876 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.0 t -102.4 134.85 42.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.459 -0.337 . . . . 73.54 111.28 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.4 t -90.77 155.3 18.89 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.833 0.349 . . . . 62.12 111.701 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.36 -30.51 69.6 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.161 0.505 . . . . 75.24 110.686 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.23 138.91 57.42 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.49 -0.777 . . . . 72.2 111.799 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.631 HG12 ' HG2' ' A' ' 29' ' ' ARG . 53.1 mt -115.9 138.17 47.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.943 0.401 . . . . 73.41 111.983 -175.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' HE3' HG12 ' A' ' 30' ' ' ILE . 32.8 mmtp -72.67 -57.18 4.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.444 0.64 . . . . 73.44 110.205 171.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HB3' ' HA ' ' A' ' 62' ' ' PRO . 8.9 pt-20 -163.92 166.15 21.99 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.489 -0.778 . . . . 60.24 111.563 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.531 HH12 ' HB2' ' A' ' 67' ' ' LEU . 31.2 mtp180 -114.3 118.34 33.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.464 -0.334 . . . . 74.44 111.5 -172.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 21.8 m -92.87 131.04 38.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 111.827 0.306 . . . . 71.12 111.827 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -120.48 143.78 48.35 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.01 0.433 . . . . 71.1 111.88 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -75.12 109.31 8.5 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.927 -0.579 . . . . 61.24 110.496 173.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.467 HD12 HG21 ' A' ' 59' ' ' VAL . 41.0 mt -111.93 131.99 55.03 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.354 0.597 . . . . 51.33 111.808 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.6 mmtm -96.07 136.42 36.54 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.947 -0.569 . . . . 55.24 110.41 176.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 N--CA 1.476 0.846 0 O-C-N 122.055 -0.403 . . . . 72.33 111.425 178.326 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 . . . . . 0 N--CA 1.471 0.624 0 CA-C-O 121.572 0.701 . . . . 75.4 112.808 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 70.5 mtp -93.14 137.43 32.49 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.245 -0.889 . . . . 72.24 110.725 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.409 HG22 ' NE1' ' A' ' 98' ' ' TRP . 40.0 pt -121.64 138.71 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 120.956 0.407 . . . . 70.4 111.114 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.7 106.41 18.72 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.519 -0.309 . . . . 72.23 111.395 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 95.7 t -105.24 128.76 58.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.441 0.534 . . . . 74.24 112.441 -176.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -113.67 132.5 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.177 -0.465 . . . . 64.4 111.645 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -110.92 136.38 20.77 Favored Pre-proline 0 N--CA 1.474 0.764 0 CA-C-O 120.522 0.201 . . . . 65.04 111.073 175.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 33.3 Cg_endo -62.28 158.44 40.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.752 2.301 . . . . 72.12 113.33 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.99 -16.65 5.15 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.823 0.675 . . . . 72.34 112.823 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -68.86 -10.23 55.84 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.159 0.429 . . . . 45.21 112.159 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 44.8 t -108.82 129.75 23.57 Favored Pre-proline 0 CA--C 1.544 0.716 0 N-CA-C 112.261 0.467 . . . . 63.24 112.261 -176.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 28.9 Cg_exo -64.74 161.68 34.9 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.742 2.295 . . . . 70.25 113.072 174.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.531 ' HB2' HH12 ' A' ' 44' ' ' ARG . 62.7 tp -67.93 134.58 51.03 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.056 0.455 . . . . 74.35 112.103 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.91 108.64 17.02 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.291 -0.413 . . . . 75.33 111.027 174.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.75 78.67 9.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.049 0.452 . . . . 65.42 110.897 176.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -112.86 150.81 31.21 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.96 0.409 . . . . 63.31 111.2 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -77.34 171.16 15.31 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.327 0.584 . . . . 63.11 111.734 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -59.39 124.37 19.8 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.178 0.513 . . . . 35.12 111.917 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.427 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 94.4 m-20 63.36 35.42 12.28 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.731 -0.668 . . . . 65.43 112.135 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.86 137.36 57.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.367 . . . . 52.1 111.803 177.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.569 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 58.3 mtp180 -67.83 97.06 0.62 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.251 -0.431 . . . . 74.43 112.057 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 107' ' ' LEU . 33.9 m -122.04 176.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 121.325 0.583 . . . . 42.35 112.527 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -159.38 179.58 8.83 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.784 -0.644 . . . . 71.23 110.448 175.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.486 HD11 HG21 ' A' ' 59' ' ' VAL . 85.5 mt -115.45 149.44 38.03 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.579 0.585 . . . . 73.3 112.579 -173.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.563 HG22 ' ND2' ' A' ' 80' ' ' ASN . 48.7 mm -83.21 -73.16 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.893 -0.594 . . . . 70.2 111.094 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.563 ' ND2' HG22 ' A' ' 79' ' ' ILE . 51.1 m-80 -121.35 87.11 44.44 Favored Pre-proline 0 N--CA 1.477 0.885 0 O-C-N 122.244 -0.285 . . . . 72.35 111.527 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.01 136.04 9.0 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 122.928 2.419 . . . . 74.35 113.577 175.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 101' ' ' LYS . 35.8 pt -128.65 134.72 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 121.037 0.446 . . . . 71.04 111.399 172.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.56 111.93 15.11 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.45 -0.341 . . . . 61.11 110.11 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 t0 . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 121.123 0.487 . . . . 74.33 111.882 -172.215 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.409 ' NE1' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.646 0 N-CA-C 114.192 1.182 . . . . 75.32 114.192 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -103.51 116.62 32.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.231 -0.895 . . . . 73.43 111.902 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.566 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 35.7 mt -105.73 104.42 16.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.353 -0.84 . . . . 64.1 110.692 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 82' ' ' ILE . 4.7 mtpm? -86.6 121.83 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 122.106 -0.371 . . . . 73.12 110.204 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.46 161.46 19.55 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.321 0.86 . . . . 61.42 113.321 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 21.5 t70 -63.91 -55.18 24.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.327 -0.851 . . . . 72.55 111.652 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -158.09 159.11 35.92 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.963 0.411 . . . . 73.11 111.364 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.48 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 57.0 mt -116.71 121.7 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.081 -0.509 . . . . 63.44 111.15 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 30.8 m -124.36 -179.13 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.401 -0.363 . . . . 74.44 110.832 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.437 ' HA ' ' HA ' ' A' ' 76' ' ' VAL . 93.9 mt -80.86 151.22 28.77 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.091 -0.381 . . . . 70.51 111.327 177.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 112.259 0.466 . . . . 73.41 112.259 -176.048 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 69.8 mt . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.543 0.211 . . . . 73.22 110.743 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 90.2 mttt -126.66 127.37 45.07 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.094 0.474 . . . . 73.45 112.157 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -67.35 136.06 54.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.88 -0.6 . . . . 74.31 111.532 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.2 p -113.51 -63.51 1.44 Allowed 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.989 -0.445 . . . . 73.0 111.229 174.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.78 -173.95 4.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.077 0.465 . . . . 52.43 111.759 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 60.4 tp -92.7 124.43 36.71 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.469 -0.332 . . . . 73.43 110.764 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 25' ' ' ARG . 4.1 tpp180 -75.84 -58.1 3.48 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.864 0.364 . . . . 73.43 111.942 -177.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -168.55 141.14 2.88 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.024 0.44 . . . . 72.34 111.817 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.9 mt-10 -101.2 98.36 8.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.714 -0.476 . . . . 75.31 109.714 171.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 m -70.15 110.8 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.356 0.598 . . . . 74.52 110.209 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 81.7 mtt180 -100.34 156.32 17.31 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.513 0.56 . . . . 73.41 112.513 -171.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.73 115.43 2.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.733 -0.667 . . . . 63.34 111.844 -174.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -88.67 119.17 28.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.278 -0.419 . . . . 73.45 110.92 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -60.59 159.91 9.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.062 0.458 . . . . 73.12 111.619 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.76 -18.03 52.37 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.098 -0.501 . . . . 71.45 111.905 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -83.36 -0.11 48.35 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.185 0.439 . . . . 70.51 112.185 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -11.22 70.72 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.169 -0.539 . . . . 75.45 113.726 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -86.98 152.19 22.61 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.418 -0.46 . . . . 60.1 111.606 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.4 t -95.04 125.62 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 120.952 0.406 . . . . 60.34 111.455 -178.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -79.73 176.39 9.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.355 0.598 . . . . 54.33 111.973 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -83.68 -23.41 31.73 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.029 -0.532 . . . . 74.31 111.208 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.61 143.7 54.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.895 0.379 . . . . 74.23 111.11 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.505 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.1 mt -101.14 141.56 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 121.045 0.45 . . . . 60.55 112.16 -174.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -82.53 -50.86 8.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.396 0.617 . . . . 72.12 109.903 174.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -165.98 159.94 16.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.426 -0.806 . . . . 51.11 110.982 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.8 mtt180 -107.58 123.59 48.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.073 0.397 . . . . 72.23 112.073 -175.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.5 m -96.24 114.07 25.72 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.739 0.304 . . . . 74.13 111.382 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -101.04 156.16 17.57 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.959 0.409 . . . . 71.5 111.762 178.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.543 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 26.8 m-20 -97.65 116.78 30.52 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.033 -0.53 . . . . 72.55 111.827 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.508 HD12 HG21 ' A' ' 59' ' ' VAL . 66.9 mt -118.86 126.77 52.56 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.05 0.453 . . . . 73.13 111.003 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HD2' ' HG3' ' A' ' 56' ' ' MET . 0.5 OUTLIER -104.74 115.49 30.41 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.978 0.418 . . . . 72.01 111.272 178.603 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.902 0.382 . . . . 65.14 110.805 178.002 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 121.293 0.568 . . . . 75.43 112.319 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.562 ' HG3' ' HD2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -94.98 133.3 38.89 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.69 -0.686 . . . . 64.12 111.616 178.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.7 pt -126.3 141.53 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 120.636 0.255 . . . . 74.45 111.084 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -105.19 111.36 24.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.032 0.444 . . . . 75.14 110.844 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 48' ' ' LEU . 92.7 t -101.98 137.59 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.385 -0.37 . . . . 62.43 111.446 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 89.0 p -124.65 128.81 49.43 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.292 0.568 . . . . 61.22 112.048 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.499 HG21 HG13 ' A' ' 105' ' ' ILE . 29.0 pt -118.91 153.92 52.84 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 115.829 -0.623 . . . . 72.11 110.69 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.43 153.28 55.29 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.406 2.071 . . . . 72.11 113.399 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -16.92 60.17 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.152 0.427 . . . . 71.34 112.152 -178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 74.5 p -66.27 -18.8 65.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.841 0.353 . . . . 75.33 111.601 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.37 124.32 53.8 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 116.562 -0.29 . . . . 74.2 111.303 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.37 169.29 18.76 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.0 2.467 . . . . 61.11 114.141 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.0 tp -70.85 128.82 37.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.908 -0.587 . . . . 73.32 111.513 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.41 114.72 23.41 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.262 0.553 . . . . 71.32 112.294 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.96 51.91 1.42 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.716 -0.674 . . . . 61.2 111.205 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -76.71 159.03 30.53 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.325 0.584 . . . . 75.11 112.108 -177.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -77.03 148.26 36.29 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.886 -0.597 . . . . 63.0 111.334 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -59.85 119.27 7.38 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.87 0.367 . . . . 74.41 111.521 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.477 HD22 ' N ' ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.99 24.83 3.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.319 0.648 . . . . 72.31 112.387 179.119 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.97 137.3 43.44 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.549 -0.296 . . . . 52.31 110.577 171.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 19' ' ' LEU . 76.2 mtm-85 -66.85 126.62 29.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.75 0.31 . . . . 74.12 111.44 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.549 HG12 HD23 ' A' ' 107' ' ' LEU . 27.1 m -129.13 151.53 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 121.285 0.564 . . . . 60.31 112.328 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.67 157.86 43.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.182 -0.463 . . . . 73.04 110.445 174.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.8 mt -106.02 141.87 36.68 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.093 0.775 . . . . 74.23 113.093 -170.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.529 HG22 ' ND2' ' A' ' 80' ' ' ASN . 38.8 mm -97.22 118.17 43.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.619 -0.718 . . . . 72.4 110.115 174.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.529 ' ND2' HG22 ' A' ' 79' ' ' ILE . 45.4 m-80 61.55 58.33 3.15 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 123.154 0.581 . . . . 71.12 111.962 -173.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -81.82 132.52 7.6 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.753 2.302 . . . . 73.31 113.745 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.1 pt -139.36 142.22 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-O 120.764 0.316 . . . . 74.53 111.241 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.03 123.16 24.67 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.246 -0.284 . . . . 65.22 110.697 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 t0 . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 121.09 0.471 . . . . 62.22 111.057 -175.677 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 114.464 1.283 . . . . 62.42 114.464 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -114.86 144.94 42.74 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.258 -1.337 . . . . 75.21 111.423 -174.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.494 ' HB ' HG22 ' A' ' 59' ' ' VAL . 61.0 mt -129.65 122.1 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.332 -0.395 . . . . 74.51 110.97 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -89.27 149.14 23.2 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 122.081 -0.387 . . . . 73.41 110.702 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.61 161.18 42.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 65.44 111.496 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.423 ' HB3' HD22 ' A' ' 80' ' ' ASN . 30.8 t70 -84.87 -30.93 24.05 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.945 0.402 . . . . 71.44 110.986 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.417 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 25.3 t0 -161.19 153.94 20.76 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.399 0.619 . . . . 61.21 112.045 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.499 HG13 HG21 ' A' ' 61' ' ' ILE . 62.0 mt -115.11 114.18 45.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.515 -0.766 . . . . 72.54 111.178 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.2 m -123.89 178.54 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.834 0.349 . . . . 43.54 111.599 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.549 HD23 HG12 ' A' ' 76' ' ' VAL . 98.0 mt -85.12 146.33 27.19 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.785 0.326 . . . . 74.31 111.68 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.805 0.336 . . . . 74.33 111.152 179.403 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.6 mt . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 110.156 -0.313 . . . . 44.52 110.156 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.605 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -118.62 139.94 50.71 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.351 0.5 . . . . 73.25 112.351 -177.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -77.13 142.6 39.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.926 -0.579 . . . . 62.11 111.282 176.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 46.3 t -123.72 -62.69 1.28 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.253 -0.431 . . . . 72.3 111.454 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.63 174.54 15.19 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.127 0.489 . . . . 70.33 111.858 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.8 tp -87.85 113.43 23.5 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.012 -0.54 . . . . 73.13 110.984 177.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 25' ' ' ARG . 11.6 tpp85 -61.44 -58.13 9.44 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.744 0.307 . . . . 64.34 111.443 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -176.71 143.08 0.44 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.413 0.523 . . . . 74.43 112.413 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -101.21 98.27 8.69 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.29 -0.633 . . . . 65.13 109.29 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 42' ' ' LYS . 30.0 m -77.46 126.6 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 120.898 0.38 . . . . 62.4 111.756 -175.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.572 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.5 mtt180 -96.03 158.26 15.52 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.89 0.376 . . . . 71.54 111.525 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mt -72.3 139.93 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 116.115 -0.493 . . . . 74.2 111.006 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -107.16 122.71 47.04 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.982 -0.449 . . . . 71.24 111.359 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -72.17 167.4 20.39 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.299 0.571 . . . . 51.44 112.22 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.92 -24.75 64.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.969 -0.559 . . . . 63.42 111.592 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -65.15 -14.06 59.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.002 0.429 . . . . 63.51 111.932 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.55 -3.24 83.49 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.13 -0.557 . . . . 74.4 112.535 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -98.3 148.73 23.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.212 0.53 . . . . 74.4 111.764 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.98 141.93 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.889 -0.596 . . . . 72.14 111.599 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -90.51 169.61 10.89 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.073 -0.512 . . . . 74.42 112.205 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -76.73 -26.96 55.22 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.812 -0.631 . . . . 73.14 110.895 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -77.42 146.21 36.7 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.614 0.721 . . . . 63.44 111.93 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.0 mt -99.46 144.83 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.591 -0.731 . . . . 73.31 111.068 -176.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.559 ' HB3' HG23 ' A' ' 28' ' ' VAL . 27.7 tptp -82.91 -57.62 3.22 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.304 -0.407 . . . . 64.53 111.076 177.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -168.38 160.93 11.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.916 0.388 . . . . 72.22 111.494 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -107.84 125.96 52.08 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.879 0.371 . . . . 75.31 111.912 -175.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -107.45 121.19 44.12 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.183 -0.462 . . . . 70.13 112.145 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.64 152.68 24.47 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.688 0.395 . . . . 75.32 111.989 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.643 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 11.9 m-20 -97.63 111.66 23.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.709 0.633 . . . . 73.44 112.709 177.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.1 mt -114.65 128.49 56.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.982 -0.553 . . . . 64.05 110.344 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.643 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 2.4 mptp? -120.29 145.95 46.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.957 0.408 . . . . 71.43 111.592 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p . . . . . 0 N--CA 1.475 0.782 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.859 176.674 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt180 . . . . . 0 N--CA 1.468 0.465 0 CA-C-O 121.163 0.506 . . . . 64.44 111.194 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.9 ptt? -111.37 141.25 45.16 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.077 -0.511 . . . . 63.12 111.516 -176.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 22.4 pt -133.49 137.32 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.164 -0.471 . . . . 72.03 111.565 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.07 114.09 26.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.784 0.326 . . . . 73.51 110.84 175.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 87.7 t -94.97 119.32 42.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.771 0.319 . . . . 62.14 111.573 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.6 m -108.68 114.76 28.83 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.999 0.428 . . . . 53.13 111.894 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 pt -108.09 154.09 41.41 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.117 -0.492 . . . . 74.3 111.079 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.57 146.78 51.74 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.747 2.298 . . . . 60.33 113.486 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.25 64.72 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.128 0.788 . . . . 72.12 113.128 -175.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 t -68.99 -19.21 64.14 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.998 0.428 . . . . 73.12 111.386 177.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.3 t -87.1 127.08 60.68 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.406 -0.361 . . . . 74.14 110.864 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.5 177.94 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.722 2.281 . . . . 72.23 113.886 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.0 tp -79.92 126.51 31.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.794 -0.639 . . . . 63.42 111.894 -175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -80.61 122.85 27.58 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.2 0.524 . . . . 75.42 111.74 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.31 76.88 1.74 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.129 0.49 . . . . 42.31 111.075 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -90.04 -172.51 3.53 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.134 0.492 . . . . 73.25 112.126 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -118.11 161.6 19.57 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 116.275 -0.42 . . . . 72.44 111.384 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.34 124.39 20.78 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.873 0.368 . . . . 70.33 111.276 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.605 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 41.9 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 112.74 0.645 . . . . 73.21 112.74 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.66 124.91 25.39 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.302 -0.249 . . . . 31.45 110.88 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -63.21 122.48 16.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.052 0.453 . . . . 54.33 111.527 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.473 HG12 HD23 ' A' ' 107' ' ' LEU . 27.6 m -126.14 140.18 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.12 0.486 . . . . 74.4 111.291 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 108' ' ' THR . 12.7 pt-20 -121.75 152.6 39.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.302 0.572 . . . . 73.11 111.126 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.6 mt -101.19 145.39 28.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.884 -0.598 . . . . 63.42 111.378 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -75.48 -70.98 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.561 -0.29 . . . . 74.02 110.664 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -122.81 86.03 50.01 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-O 120.72 0.295 . . . . 72.42 111.477 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.55 150.14 14.77 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.976 2.45 . . . . 60.32 113.502 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.1 pt -140.97 132.36 28.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 73.11 110.637 171.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.96 125.02 28.83 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 116.575 -0.284 . . . . 64.03 110.96 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 . . . . . 0 CA--C 1.539 0.548 0 CA-C-O 121.148 0.499 . . . . 73.41 111.105 -177.998 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 8.8 p-90 . . . . . 0 N--CA 1.473 0.7 0 N-CA-C 113.031 0.752 . . . . 73.43 113.031 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -112.68 140.43 47.45 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.134 0.79 . . . . 65.24 113.134 -172.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 57.2 mt -123.33 113.46 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.209 -0.905 . . . . 75.33 110.39 173.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -84.39 136.22 33.96 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.157 -0.339 . . . . 73.01 110.246 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.94 164.48 30.07 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.263 0.838 . . . . 53.44 113.263 -173.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.54 -66.65 0.63 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.259 -0.882 . . . . 73.51 111.183 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -141.37 162.46 35.43 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.084 0.468 . . . . 74.25 111.572 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 37.4 mt -125.87 121.46 59.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.812 -0.631 . . . . 55.11 110.979 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.1 m -130.99 172.15 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 120.745 0.307 . . . . 71.01 111.55 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.473 HD23 HG12 ' A' ' 76' ' ' VAL . 92.3 mt -76.74 135.82 39.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.602 0.239 . . . . 71.33 111.25 177.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.405 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 6.2 m . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 116.512 -0.313 . . . . 70.2 111.371 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 mt . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.783 0.325 . . . . 70.41 110.987 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 61.1 mttp -114.31 118.17 33.16 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.093 0.473 . . . . 61.13 112.082 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.39 115.07 13.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.029 -0.532 . . . . 72.33 111.391 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.2 p -99.25 -60.87 1.45 Allowed 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.075 0.398 . . . . 63.1 112.075 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.25 177.88 10.57 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.863 0.69 . . . . 65.2 112.863 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.3 tp -81.98 119.52 24.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.477 -0.783 . . . . 74.51 110.604 173.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 8.5 tpt180 -74.89 -55.76 5.46 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.064 0.394 . . . . 72.43 112.064 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -170.67 143.1 2.11 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.897 0.332 . . . . 72.41 111.897 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -110.49 118.96 37.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.747 0.308 . . . . 73.3 110.588 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.9 m -96.73 117.71 41.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 121.021 0.439 . . . . 65.33 110.619 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.615 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 78.5 mtt180 -91.76 179.52 5.61 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.363 0.601 . . . . 75.22 112.511 -175.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.0 mt -97.83 114.22 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.633 -0.712 . . . . 64.45 110.989 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.3 tt0 -81.28 130.2 34.93 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.284 0.564 . . . . 73.22 111.527 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.453 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.4 m-20 -80.63 145.78 31.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.792 -0.64 . . . . 74.01 110.682 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -63.36 -18.12 63.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.118 0.485 . . . . 73.33 111.166 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.35 -17.91 63.09 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.937 -0.574 . . . . 72.43 111.703 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.01 -49.15 0.89 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.379 -0.439 . . . . 55.24 113.175 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.5 m -74.45 155.92 37.52 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.067 0.461 . . . . 75.41 111.638 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 40.4 t -96.39 124.33 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.489 -0.323 . . . . 75.42 111.314 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.453 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 47.8 t -59.68 164.46 3.62 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.809 0.67 . . . . 54.15 112.809 -177.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.615 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 10.2 m-20 -81.56 -2.72 51.02 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.963 -0.562 . . . . 74.02 110.659 171.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.85 124.84 27.59 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.057 -0.52 . . . . 74.1 109.949 170.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 48.9 mt -95.46 140.88 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.748 0.309 . . . . 73.53 110.854 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -87.27 -59.55 2.22 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.724 0.297 . . . . 62.22 110.963 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -137.64 161.05 37.5 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.402 0.62 . . . . 71.52 111.772 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -132.61 111.24 11.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.68 -0.691 . . . . 65.35 110.856 -177.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 31.0 m -95.14 131.65 40.92 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.409 0.522 . . . . 74.23 112.409 -175.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -113.33 152.2 30.22 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.772 0.429 . . . . 72.33 111.444 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.516 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 48.8 m-20 -88.11 110.11 20.4 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.283 -0.417 . . . . 73.31 111.217 174.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.652 HD12 HG21 ' A' ' 59' ' ' VAL . 41.2 mt -114.53 130.63 56.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.993 0.425 . . . . 62.14 110.847 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.0 mmtm -87.29 118.03 26.44 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.83 0.348 . . . . 74.34 110.832 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.323 0.582 . . . . 73.34 112.399 -176.492 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 120.974 0.416 . . . . 74.45 111.696 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -70.07 132.75 46.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.038 -0.528 . . . . 51.41 109.815 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.455 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 34.0 pt -103.48 118.11 50.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.126 0.489 . . . . 62.05 110.838 177.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -87.4 104.33 16.34 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.097 0.475 . . . . 74.42 109.741 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.652 HG21 HD12 ' A' ' 48' ' ' LEU . 90.3 t -94.39 119.74 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-O 121.105 0.479 . . . . 74.31 112.25 -172.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.2 m -106.7 121.97 45.41 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.994 -0.548 . . . . 71.24 111.29 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.451 HG21 HG13 ' A' ' 105' ' ' ILE . 36.9 pt -119.33 145.91 39.68 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 116.657 -0.247 . . . . 65.41 110.62 174.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.47 134.64 64.8 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.113 1.875 . . . . 75.21 112.261 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.76 -7.17 6.99 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.805 0.669 . . . . 65.25 112.805 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.5 p -70.46 -20.06 62.91 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 120.719 0.295 . . . . 51.22 110.883 173.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.5 t -82.1 133.47 51.07 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.981 -0.554 . . . . 65.21 110.747 175.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.64 151.19 7.9 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.14 2.56 . . . . 63.44 114.421 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 68.2 tp -63.96 136.34 57.26 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.926 -0.579 . . . . 73.2 112.197 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -92.52 125.21 37.06 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.15 0.5 . . . . 45.43 111.339 175.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -113.29 72.01 0.76 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.923 -0.58 . . . . 74.51 111.007 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -102.87 170.32 8.06 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.412 0.625 . . . . 72.4 111.856 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.6 168.34 10.59 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.54 -0.755 . . . . 74.31 111.496 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.23 130.68 44.05 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.912 0.387 . . . . 71.13 111.851 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.419 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 96.3 m-20 62.12 21.98 12.8 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.225 0.61 . . . . 71.31 112.222 -177.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.16 127.95 34.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.621 0.248 . . . . 70.12 111.038 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -62.05 116.26 4.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.125 0.488 . . . . 75.24 111.593 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 HD23 ' A' ' 107' ' ' LEU . 29.5 m -129.09 152.87 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.073 -0.512 . . . . 73.33 111.888 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.08 152.55 50.98 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.086 0.469 . . . . 73.12 110.461 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.0 mt -98.19 144.96 27.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.167 0.803 . . . . 60.11 113.167 -170.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.47 HG22 HD22 ' A' ' 80' ' ' ASN . 47.6 mm -92.37 113.51 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.378 -0.828 . . . . 75.44 110.31 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.47 HD22 HG22 ' A' ' 79' ' ' ILE . 51.1 m-80 48.3 67.69 4.25 Favored Pre-proline 0 N--CA 1.48 1.041 0 N-CA-C 112.776 0.658 . . . . 71.24 112.776 -176.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.49 146.27 15.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.869 2.379 . . . . 71.42 113.429 177.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 46.8 pt -136.81 140.95 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 122.659 0.384 . . . . 72.52 111.002 176.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.35 124.9 25.31 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.188 -0.32 . . . . 61.32 110.709 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.5 t0 . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 121.469 0.652 . . . . 33.54 111.25 -175.438 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.455 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 122.309 1.052 . . . . 75.53 113.681 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -107.08 148.38 28.85 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.741 -1.118 . . . . 65.4 111.237 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 38.2 mt -123.53 113.54 37.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 110.052 -0.351 . . . . 50.11 110.052 174.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -85.35 132.64 34.21 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 122.224 -0.297 . . . . 54.44 110.691 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -127.13 151.14 49.05 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.335 0.494 . . . . 72.53 112.335 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.16 -31.29 67.51 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.066 -0.515 . . . . 71.54 110.777 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -167.03 161.26 14.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.015 -0.539 . . . . 75.23 111.413 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.451 HG13 HG21 ' A' ' 61' ' ' ILE . 42.2 mt -122.83 116.71 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.356 -0.384 . . . . 74.3 111.174 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.2 m -124.35 171.32 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.903 0.383 . . . . 73.02 111.478 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.523 HD23 HG12 ' A' ' 76' ' ' VAL . 97.5 mt -75.62 145.34 41.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.479 -0.328 . . . . 63.51 110.809 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.536 0.439 0 CA-C-O 120.663 0.268 . . . . 61.2 110.974 177.2 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 92.1 mt . . . . . 0 CA--C 1.535 0.377 0 CA-C-O 120.848 0.356 . . . . 75.42 110.643 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.495 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 7.1 mtmp? -136.21 140.82 43.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.52 -0.309 . . . . 73.23 111.305 -176.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -65.4 135.48 55.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.095 0.406 . . . . 73.14 112.095 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.0 m -116.14 -63.96 1.38 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.835 0.35 . . . . 72.14 111.428 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.26 -173.68 4.15 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.043 0.449 . . . . 63.55 111.747 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.6 tp -102.09 127.24 49.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.393 -0.367 . . . . 61.52 110.177 171.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -79.63 -68.47 0.66 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.969 0.414 . . . . 75.4 111.951 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -163.42 145.6 9.8 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.275 0.472 . . . . 71.55 112.275 -171.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -106.67 103.1 12.46 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.286 -0.416 . . . . 62.11 110.911 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 m -76.6 109.98 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.344 0.592 . . . . 63.32 111.172 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 70.0 mtp180 -92.67 170.43 9.72 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.2 -0.455 . . . . 70.25 111.957 -174.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 40' ' ' GLU . 48.6 mt -80.82 144.18 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.484 -0.325 . . . . 73.22 111.1 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -110.48 133.25 53.46 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.767 0.318 . . . . 64.45 111.028 176.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.6 m-20 -79.68 162.43 25.23 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.49 0.552 . . . . 74.03 112.49 -175.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.89 -38.71 67.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.73 -0.668 . . . . 65.31 110.869 174.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.25 -37.44 67.22 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.534 -0.757 . . . . 73.41 111.539 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.25 -32.18 4.99 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 116.061 -0.518 . . . . 60.31 111.952 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 54.8 m -62.7 166.54 5.33 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.055 0.455 . . . . 75.12 111.737 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.31 146.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.933 0.397 . . . . 73.14 111.507 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 32.7 t -94.65 156.62 16.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.093 0.473 . . . . 72.44 111.508 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.452 ' HA ' ' NH2' ' A' ' 29' ' ' ARG . 13.5 t70 -67.06 -31.56 72.15 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.177 -0.465 . . . . 64.14 111.043 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.439 ' HB2' HD12 ' A' ' 30' ' ' ILE . 16.9 mm-40 -73.45 152.53 40.73 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.434 0.635 . . . . 73.13 112.008 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 56.9 mt -114.56 147.17 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.972 -0.558 . . . . 53.33 111.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.57 -60.51 2.23 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.064 0.459 . . . . 72.52 111.411 176.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -147.04 167.44 24.06 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.105 -0.498 . . . . 73.35 111.019 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -128.93 118.21 22.26 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.243 -0.435 . . . . 73.04 110.739 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.2 m -95.76 124.97 40.02 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.385 0.513 . . . . 72.32 112.385 -175.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -106.4 167.87 9.54 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.086 0.47 . . . . 72.53 111.568 177.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -112.38 116.15 29.87 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.78 -0.646 . . . . 74.25 111.031 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -121.6 121.06 36.57 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 73.21 111.238 178.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 56' ' ' MET . 20.2 ptmt -96.45 128.47 43.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.395 0.617 . . . . 62.35 111.603 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 121.175 0.512 . . . . 65.31 111.893 -177.354 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 . . . . . 0 N--CA 1.47 0.564 0 CA-C-O 121.097 0.475 . . . . 72.15 111.582 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.484 ' HA ' ' HA ' ' A' ' 49' ' ' LYS . 22.8 ptp -105.45 144.11 32.68 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.903 -0.59 . . . . 63.5 111.441 176.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 100' ' ' ILE . 24.0 pt -106.06 144.62 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 116.103 -0.499 . . . . 62.14 110.598 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -87.74 105.43 17.38 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.836 0.35 . . . . 62.53 111.017 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.47 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -101.1 119.62 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 N-CA-C 112.218 0.451 . . . . 74.32 112.218 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.538 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 39.2 m -106.79 129.13 54.7 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.989 0.423 . . . . 43.13 111.623 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.9 pt -126.7 149.85 69.52 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 116.508 -0.315 . . . . 64.41 110.645 174.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -55.69 141.82 83.54 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.486 2.124 . . . . 73.31 112.843 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.27 -18.13 34.74 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.59 0.589 . . . . 65.23 112.59 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 45.1 t -62.38 -27.95 69.43 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.851 0.358 . . . . 63.41 111.484 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.7 t -77.08 128.58 80.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 116.512 -0.313 . . . . 73.25 111.034 178.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 155.42 33.45 Favored 'Trans proline' 0 CA--C 1.544 1.008 0 C-N-CA 122.797 2.331 . . . . 62.43 113.667 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.52 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 26.7 tp -67.89 134.42 50.82 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.095 -0.502 . . . . 64.43 111.749 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.414 ' H ' HD12 ' A' ' 67' ' ' LEU . 61.1 mmtt -83.74 -70.99 0.53 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.844 0.683 . . . . 74.33 112.844 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.52 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 50.6 mt-10 55.6 49.85 15.68 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 120.702 0.287 . . . . 71.43 111.608 -175.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -66.65 169.56 7.6 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.119 0.485 . . . . 75.23 112.072 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 3.9 m-20 -60.66 138.3 58.09 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.994 -0.548 . . . . 74.22 111.061 176.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -62.68 125.31 23.51 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 116.389 -0.369 . . . . 71.01 111.615 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 69.32 17.63 8.18 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.593 0.757 . . . . 70.21 112.914 -176.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.541 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -80.21 146.33 31.79 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.991 -0.443 . . . . 71.21 111.265 175.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 75.4 mtt180 -69.99 114.81 8.52 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.046 0.45 . . . . 74.43 111.681 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.554 HG12 HD23 ' A' ' 107' ' ' LEU . 27.4 m -126.93 140.42 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.075 -0.511 . . . . 74.33 111.146 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.7 pt-20 -121.66 155.9 34.16 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.242 0.544 . . . . 74.43 111.331 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -98.86 122.14 41.72 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.373 0.509 . . . . 60.53 112.373 -174.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -72.5 108.53 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 115.956 -0.565 . . . . 74.11 110.331 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 55.57 67.02 3.27 Favored Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 112.817 0.673 . . . . 74.11 112.817 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.87 137.7 10.03 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.778 2.318 . . . . 63.24 113.633 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 101' ' ' LYS . 40.1 pt -120.59 141.95 38.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 121.029 0.442 . . . . 73.02 110.995 174.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.72 129.0 36.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.611 -0.268 . . . . 72.12 110.468 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.1 t0 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 121.277 0.56 . . . . 74.22 111.998 -174.825 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.805 0 N-CA-C 113.754 1.02 . . . . 75.45 113.754 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -107.32 143.92 34.91 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.828 -1.078 . . . . 72.11 111.614 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 57' ' ' ILE . 63.2 mt -131.87 131.68 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.976 -0.556 . . . . 72.44 110.315 176.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.538 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 32.9 mtmm -109.14 126.03 52.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.761 0.315 . . . . 75.1 111.228 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.76 162.95 16.88 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.5 0.556 . . . . 72.45 112.5 -173.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -73.27 -29.15 62.54 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.583 -0.735 . . . . 73.4 110.542 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -174.45 162.63 3.53 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.995 -0.548 . . . . 74.32 111.266 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 34.2 mt -118.98 119.92 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.44 -0.345 . . . . 71.53 110.665 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.72 174.13 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-O 120.905 0.384 . . . . 74.22 111.834 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.554 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -77.53 132.29 38.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.66 -0.246 . . . . 70.4 111.023 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 87.6 m . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 112.108 0.41 . . . . 73.34 112.108 -177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.8 mt . . . . . 0 CA--C 1.532 0.255 0 CA-C-O 120.732 0.301 . . . . 71.35 110.189 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 73' ' ' ASN . 9.0 mtpm? -101.63 120.88 41.02 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.129 0.49 . . . . 71.35 111.729 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.482 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 35.7 t80 -59.34 115.21 3.09 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.454 -0.793 . . . . 72.3 110.371 173.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.479 ' OG ' ' HG2' ' A' ' 49' ' ' LYS . 49.7 m -98.69 -64.42 1.04 Allowed 'General case' 0 N--CA 1.474 0.735 0 O-C-N 122.12 -0.362 . . . . 65.34 111.958 -178.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.28 176.96 11.12 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.287 0.565 . . . . 52.52 112.257 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.3 tp -91.25 107.32 19.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.809 -0.632 . . . . 70.02 110.513 175.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -61.66 -59.2 5.55 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.43 -0.35 . . . . 73.54 111.7 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -173.26 130.51 0.47 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.508 0.559 . . . . 74.41 112.508 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -98.58 99.54 10.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.99 -0.55 . . . . 73.42 110.102 171.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 m -77.71 115.54 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.027 0.442 . . . . 61.5 111.285 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.565 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 78.8 mtt85 -87.29 168.45 13.18 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.265 0.555 . . . . 73.22 112.153 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.3 mt -79.4 122.15 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 60.2 111.786 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -91.94 112.59 24.58 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.9 0.381 . . . . 71.12 111.035 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -59.17 162.88 4.1 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.64 0.608 . . . . 65.12 112.64 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.35 -32.7 57.46 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 116.171 -0.468 . . . . 65.31 111.345 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.14 -7.26 22.05 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.493 0.553 . . . . 54.3 112.493 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 93.33 -10.28 73.42 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.234 -0.508 . . . . 73.24 113.27 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -93.4 145.41 24.5 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.39 -0.476 . . . . 40.44 111.518 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 28.9 t -75.49 151.72 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.525 -0.307 . . . . 74.54 111.521 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -105.1 170.99 7.56 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.09 0.471 . . . . 72.4 111.679 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.26 -28.25 64.02 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.993 -0.549 . . . . 71.44 110.945 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -74.96 146.15 41.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.313 0.577 . . . . 71.12 112.225 -177.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 51.3 mt -99.0 153.63 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 115.655 -0.702 . . . . 74.54 111.348 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 24.0 tptm -108.83 -58.64 1.99 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.859 0.362 . . . . 70.34 111.359 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.6 mt-10 -136.33 139.97 42.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.057 0.456 . . . . 72.53 111.286 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -107.53 112.43 25.19 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 116.347 -0.388 . . . . 74.31 111.203 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.6 m -103.64 122.23 44.58 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.702 0.63 . . . . 72.23 112.702 -177.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -105.83 161.16 14.67 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.341 0.656 . . . . 73.22 111.574 175.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -108.41 116.23 31.58 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.321 -0.4 . . . . 74.43 110.899 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.644 HD12 HG21 ' A' ' 59' ' ' VAL . 65.5 mt -113.12 144.4 42.7 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.699 0.285 . . . . 53.31 110.747 176.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG2' ' OG ' ' A' ' 22' ' ' SER . 14.7 mmmm -102.4 126.13 49.33 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.779 0.324 . . . . 72.42 111.314 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 55.04 111.608 178.336 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 . . . . . 0 CA--C 1.537 0.444 0 CA-C-O 120.7 0.286 . . . . 74.41 111.099 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.9 ptp -95.11 114.18 25.95 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 121.121 0.486 . . . . 70.2 112.218 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 28.9 pt -99.01 135.67 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.307 -0.406 . . . . 71.32 110.654 175.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.0 mp0 -87.05 104.28 16.17 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.933 0.397 . . . . 71.44 110.637 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 48' ' ' LEU . 91.9 t -94.94 114.23 31.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.954 0.407 . . . . 73.55 111.423 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.483 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 29.5 t -107.52 131.49 54.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.098 0.475 . . . . 75.11 111.693 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.9 pt -123.51 147.86 54.02 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 115.947 -0.57 . . . . 61.52 111.313 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -53.27 151.4 22.63 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.999 2.466 . . . . 73.24 113.911 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.02 -47.65 61.61 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.664 0.987 . . . . 75.11 113.664 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.5 m -70.49 -4.12 21.22 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.906 0.706 . . . . 63.33 112.906 -174.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.25 119.84 77.71 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 120.581 0.229 . . . . 75.33 110.496 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.18 142.94 44.02 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.942 2.428 . . . . 45.15 113.693 -176.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.99 128.58 36.18 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.041 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -79.35 -63.7 1.36 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.407 0.521 . . . . 72.01 112.407 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 58.64 48.97 10.95 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 112.625 0.602 . . . . 72.51 112.625 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -75.99 -166.01 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.054 0.454 . . . . 75.23 112.071 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -91.48 158.74 16.31 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.406 0.521 . . . . 73.34 112.406 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.6 t80 -60.12 -22.1 62.4 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.891 0.701 . . . . 74.22 112.891 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.427 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 15.3 m120 -114.54 20.88 15.02 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.883 -0.511 . . . . 62.5 111.308 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.63 117.61 20.7 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.865 0.364 . . . . 53.24 111.734 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -73.53 111.28 8.52 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.282 -0.417 . . . . 73.45 111.008 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.558 HG12 HD23 ' A' ' 107' ' ' LEU . 34.6 m -117.41 159.32 17.63 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.286 0.565 . . . . 34.1 112.401 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -135.85 152.55 51.17 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.217 -0.447 . . . . 45.23 110.979 173.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.5 mt -100.73 138.54 37.64 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.552 0.575 . . . . 61.21 112.552 -173.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.427 HG22 HD22 ' A' ' 80' ' ' ASN . 49.4 mm -86.21 111.54 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.883 -0.598 . . . . 75.14 110.698 176.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.427 HD22 HG22 ' A' ' 79' ' ' ILE . 42.0 m-80 47.04 70.26 2.19 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.958 0.725 . . . . 54.01 112.958 -177.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.33 151.95 17.91 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.982 2.455 . . . . 63.44 113.668 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 pt -141.1 139.99 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.22 -0.446 . . . . 73.42 111.054 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -89.24 102.71 15.37 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.675 0.274 . . . . 73.24 111.021 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t70 . . . . . 0 CA--C 1.55 0.952 0 CA-C-O 121.006 0.431 . . . . 75.34 111.54 -174.147 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 113.787 1.032 . . . . 74.35 113.787 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 34.7 m-85 -115.65 129.11 56.37 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.726 -1.124 . . . . 75.02 112.793 -174.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 55.7 mt -104.14 108.02 23.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.998 -0.546 . . . . 75.53 109.728 169.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.483 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 52.0 mtpt -93.48 138.49 31.72 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.501 -0.318 . . . . 73.01 111.464 -174.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.31 171.86 13.86 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.546 0.572 . . . . 62.44 112.546 -175.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 -42.55 40.71 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.712 -0.676 . . . . 64.33 111.252 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -163.95 158.62 19.89 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.164 -0.471 . . . . 74.31 111.07 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.538 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 42.1 mt -116.57 115.84 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 116.53 -0.305 . . . . 65.5 110.936 -179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.91 179.08 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 120.838 0.351 . . . . 62.02 111.314 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.558 HD23 HG12 ' A' ' 76' ' ' VAL . 97.9 mt -86.31 142.21 28.68 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.687 0.28 . . . . 74.23 110.889 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.389 . . . . 74.41 110.975 -179.727 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.1 mt . . . . . 0 N--CA 1.465 0.283 0 N-CA-C 109.608 -0.515 . . . . 65.43 109.608 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 mtpt -101.66 115.71 31.12 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.155 0.503 . . . . 75.23 110.802 -174.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.441 ' HA ' ' CD2' ' A' ' 48' ' ' LEU . 51.6 t80 -60.17 143.77 51.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.408 -0.814 . . . . 74.04 112.536 -174.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.542 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 34.3 t -121.3 -66.39 1.05 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.851 0.315 . . . . 62.3 111.851 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.91 178.01 9.29 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.027 0.441 . . . . 53.4 112.181 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 67' ' ' LEU . 58.6 tp -94.6 107.46 19.45 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.795 -0.446 . . . . 60.44 109.795 170.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 25' ' ' ARG . 15.7 tpt180 -65.23 -60.29 3.15 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.277 0.473 . . . . 71.43 112.277 -173.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -165.86 138.08 4.01 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.161 0.43 . . . . 74.24 112.161 -175.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 44' ' ' ARG . 39.2 mt-10 -96.51 101.83 13.52 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.284 -0.416 . . . . 71.11 110.079 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.3 m -69.83 125.92 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.118 0.485 . . . . 72.32 111.234 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.444 ' HG2' HG12 ' A' ' 41' ' ' ILE . 65.2 mtt85 -104.88 151.97 23.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.433 0.635 . . . . 71.13 112.373 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -66.81 122.03 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.083 -0.962 . . . . 62.0 112.438 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -99.27 132.82 44.33 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.425 -0.352 . . . . 72.34 111.048 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -86.11 169.66 12.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.498 0.555 . . . . 72.14 112.498 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 33' ' ' GLU . 2.4 mp0 -59.12 -35.79 74.06 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.559 -0.746 . . . . 62.51 111.499 -179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -60.49 -28.46 68.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.104 -0.498 . . . . 64.52 112.015 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.73 -29.67 7.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 121.177 -0.535 . . . . 33.43 112.368 -174.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.9 m -65.18 143.29 57.95 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.07 0.462 . . . . 64.02 111.62 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.79 135.48 35.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.057 0.456 . . . . 75.01 111.763 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.3 t -82.53 158.08 23.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.828 -0.624 . . . . 43.21 111.506 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -74.43 -8.13 55.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.135 0.493 . . . . 62.44 110.835 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.09 132.45 43.32 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.865 -0.607 . . . . 53.5 110.893 175.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 ' HG2' ' A' ' 29' ' ' ARG . 52.7 mt -97.99 148.6 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 120.835 0.35 . . . . 74.15 111.497 -175.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -102.73 -57.44 2.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.75 0.309 . . . . 71.44 111.068 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.02 151.97 44.5 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.884 0.373 . . . . 74.35 111.218 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 1.7 ptp180 -116.67 117.14 28.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.231 0.539 . . . . 64.34 111.27 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.1 m -91.48 123.52 34.96 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 73.14 112.584 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.502 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.5 m-85 -104.36 148.03 26.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.036 0.534 . . . . 74.24 110.943 174.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -94.5 120.9 35.44 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.839 0.352 . . . . 75.54 110.867 174.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 59' ' ' VAL . 63.4 mt -123.55 145.72 48.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.708 0.289 . . . . 71.34 110.821 177.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HE2' ' HB2' ' A' ' 22' ' ' SER . 0.0 OUTLIER -112.3 141.64 45.78 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.989 0.424 . . . . 65.15 111.007 174.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 73.23 111.822 -177.896 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 120.911 0.386 . . . . 75.12 111.543 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptm -95.39 148.26 22.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.516 0.675 . . . . 74.2 111.892 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 100' ' ' ILE . 22.5 pt -130.78 150.88 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 115.414 -0.812 . . . . 72.53 109.759 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.675 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -107.01 105.35 15.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.205 -0.998 . . . . 71.35 111.32 177.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.606 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -94.72 121.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.307 -0.406 . . . . 75.54 111.303 -177.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' ' HG2' ' A' ' 101' ' ' LYS . 91.3 p -113.63 131.75 56.02 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.418 0.628 . . . . 72.05 111.503 -178.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.9 pt -122.86 145.4 45.43 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.724 -0.671 . . . . 72.11 110.302 175.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.82 147.74 17.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.45 2.1 . . . . 61.15 113.231 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.2 -22.71 63.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.882 0.372 . . . . 61.21 111.701 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 57.5 p -65.51 -21.38 66.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.305 -0.407 . . . . 70.32 111.742 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.3 t -85.54 124.5 71.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-N 116.562 -0.29 . . . . 74.43 110.939 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.92 159.45 7.22 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.161 2.574 . . . . 55.03 114.617 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 45.2 tp -75.4 128.42 35.33 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.981 -0.554 . . . . 64.03 111.186 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.92 -64.26 1.2 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.942 0.719 . . . . 74.01 112.942 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.534 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.7 mt-10 57.02 52.66 8.9 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.843 0.683 . . . . 72.41 112.843 -178.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.48 173.0 9.45 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.006 -0.434 . . . . 72.2 111.464 173.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.16 160.57 31.85 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.974 0.416 . . . . 74.44 111.845 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -71.2 134.46 46.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.941 -0.392 . . . . 73.41 109.941 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 68.52 12.66 8.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.983 0.513 . . . . 75.35 112.153 -175.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.49 136.96 54.0 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.88 0.372 . . . . 54.4 111.576 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -78.27 104.59 8.95 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.439 -0.346 . . . . 74.31 110.873 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 32.5 m -124.62 154.62 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 121.311 0.577 . . . . 55.35 111.955 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -130.01 155.69 45.7 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.26 0.552 . . . . 73.22 110.866 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.2 mt -103.04 139.28 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.529 0.68 . . . . 63.44 112.421 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.466 HG22 HD22 ' A' ' 80' ' ' ASN . 45.6 mm -85.06 106.66 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.581 -0.736 . . . . 65.44 110.518 175.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.466 HD22 HG22 ' A' ' 79' ' ' ILE . 51.3 m-80 54.6 68.57 2.57 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.335 0.494 . . . . 71.3 112.335 -176.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.04 130.8 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.724 2.282 . . . . 63.11 113.452 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 pt -124.91 142.97 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.734 0.302 . . . . 74.22 111.317 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.66 115.78 26.44 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.6 0.238 . . . . 73.21 110.914 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 121.168 0.509 . . . . 71.43 111.226 -179.655 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.548 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.259 1.562 0 CA-C-O 122.84 1.305 . . . . 74.34 114.275 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.675 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 80.1 m-85 -84.86 112.81 20.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 113.377 -1.738 . . . . 75.03 110.418 169.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 57' ' ' ILE . 30.4 mt -90.43 104.34 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.3 0.571 . . . . 62.51 109.698 177.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.549 ' HG2' ' OG ' ' A' ' 60' ' ' SER . 96.5 mttt -85.21 131.5 34.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 55.41 111.618 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.93 155.62 45.76 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.177 0.513 . . . . 73.5 112.194 -177.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -68.83 -39.14 80.14 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.753 -0.658 . . . . 65.13 110.94 176.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -164.31 162.09 22.19 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.029 -0.532 . . . . 74.1 111.422 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.47 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 39.9 mt -118.75 115.93 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.363 -0.38 . . . . 74.22 111.077 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -125.01 170.52 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-O 120.743 0.306 . . . . 73.21 111.682 -178.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.2 mt -72.15 139.09 48.12 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 75.31 110.921 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.47 0.538 0 CA-C-N 116.605 -0.271 . . . . 50.55 111.722 179.639 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 70.0 mt . . . . . 0 CA--C 1.533 0.326 0 CA-C-O 121.209 0.528 . . . . 70.23 111.278 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.721 ' HG2' ' HA ' ' A' ' 73' ' ' ASN . 0.2 OUTLIER -158.49 133.31 8.31 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.002 0.43 . . . . 74.43 111.894 -179.606 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.465 ' HA ' HD22 ' A' ' 48' ' ' LEU . 36.1 t80 -72.74 143.99 47.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.118 -0.492 . . . . 75.35 111.566 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 t -125.03 -65.39 1.03 Allowed 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.348 -0.22 . . . . 62.45 111.413 174.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.16 -173.84 4.06 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.916 0.388 . . . . 64.31 112.039 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.4 tp -94.94 133.08 39.08 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.806 0.336 . . . . 74.45 111.134 174.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -88.29 -65.06 1.06 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.837 0.351 . . . . 75.04 111.836 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -164.32 142.93 7.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.846 0.355 . . . . 70.12 111.698 -176.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -106.59 98.98 8.59 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.871 -0.418 . . . . 75.32 109.871 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.444 ' O ' HG23 ' A' ' 28' ' ' VAL . 28.8 m -71.8 92.3 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 121.864 0.84 . . . . 73.12 111.352 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.652 ' HG2' HG12 ' A' ' 41' ' ' ILE . 71.5 mtt180 -83.34 159.45 21.86 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.583 -0.735 . . . . 74.42 112.344 -177.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.9 mt -81.01 132.93 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.56 -0.745 . . . . 74.41 110.911 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -110.57 128.17 55.54 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.837 0.351 . . . . 75.14 110.536 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -67.79 153.39 43.82 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.638 0.606 . . . . 72.42 112.638 -173.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.95 -36.94 60.58 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.281 0.563 . . . . 55.25 110.742 172.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -51.05 -42.65 60.66 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.377 -0.829 . . . . 61.15 111.617 175.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.95 -39.98 1.64 Allowed Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.367 -0.444 . . . . 64.12 112.55 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.5 m -68.98 148.27 50.38 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.183 0.516 . . . . 73.34 111.938 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.64 137.73 20.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.081 -0.509 . . . . 64.12 111.673 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -88.6 166.92 13.8 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.108 0.48 . . . . 72.15 111.727 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -87.81 -7.62 57.03 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.359 -0.382 . . . . 64.21 110.95 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.18 135.74 46.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.912 0.387 . . . . 74.23 110.318 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.652 HG12 ' HG2' ' A' ' 29' ' ' ARG . 39.1 mt -111.48 157.75 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.158 0.504 . . . . 70.21 111.564 -173.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -97.32 -55.1 2.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.073 0.463 . . . . 65.21 110.387 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.419 ' H ' HG23 ' A' ' 28' ' ' VAL . 33.3 mt-10 -143.9 155.35 44.05 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.989 -0.55 . . . . 71.25 111.348 175.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.439 ' O ' HG12 ' A' ' 61' ' ' ILE . 39.7 ttm180 -115.99 110.65 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.985 0.421 . . . . 73.34 110.241 175.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 90.9 m -94.98 125.55 39.72 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.292 0.479 . . . . 73.34 112.292 -175.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -108.06 158.08 17.71 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.26 0.553 . . . . 73.42 112.371 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -96.55 107.21 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.539 -0.755 . . . . 75.42 110.659 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.775 HD12 HG21 ' A' ' 59' ' ' VAL . 56.6 mt -120.43 160.56 22.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.204 0.526 . . . . 65.21 111.433 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -115.45 145.6 42.43 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.235 -0.438 . . . . 75.13 110.871 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.1 m . . . . . 0 N--CA 1.475 0.796 0 O-C-N 122.216 -0.303 . . . . 45.24 111.759 179.98 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 121.071 0.462 . . . . 65.35 111.407 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.87 149.19 22.75 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.115 0.483 . . . . 74.34 111.134 176.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.573 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 31.2 pt -124.46 136.3 61.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 72.35 110.668 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.768 ' HA ' HE21 ' A' ' 58' ' ' GLN . 0.0 OUTLIER -94.58 104.41 16.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.428 -0.509 . . . . 62.51 110.461 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.775 HG21 HD12 ' A' ' 48' ' ' LEU . 95.6 t -95.01 117.05 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.937 0.347 . . . . 74.24 111.937 -174.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.7 m -106.97 116.55 32.11 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.381 -0.372 . . . . 53.03 111.191 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HG13 ' A' ' 105' ' ' ILE . 21.8 pt -110.16 148.9 39.29 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.186 -0.461 . . . . 73.33 111.126 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.34 153.85 56.98 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.517 2.145 . . . . 51.52 113.195 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.42 -19.19 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.55 0.574 . . . . 34.41 112.55 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.8 m -68.35 -9.33 47.3 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.686 0.279 . . . . 70.54 111.689 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.456 HG11 HD12 ' A' ' 61' ' ' ILE . 45.5 t -92.8 132.14 31.96 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 116.481 -0.327 . . . . 64.43 111.501 179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -177.09 1.9 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.594 2.196 . . . . 73.42 113.778 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' A' ' 69' ' ' GLU . 30.9 tp -82.67 141.68 32.27 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.088 -0.506 . . . . 75.11 111.806 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.405 ' HE2' HG12 ' A' ' 65' ' ' VAL . 4.7 mptp? -102.4 -68.2 0.84 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.858 0.361 . . . . 75.24 111.643 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 38.1 mm-40 50.75 56.12 8.48 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.668 0.618 . . . . 75.42 112.668 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -75.73 171.49 14.27 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.0 0.429 . . . . 71.13 111.189 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -71.52 151.46 43.87 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 75.1 112.305 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.409 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 82.0 t80 -56.98 121.85 10.91 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.726 -0.67 . . . . 65.02 110.798 174.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.721 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.9 OUTLIER 72.09 30.39 2.16 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.678 0.622 . . . . 74.12 112.678 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -84.25 145.1 28.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.535 -0.302 . . . . 62.11 110.512 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -74.46 114.99 13.48 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.165 -0.335 . . . . 72.13 111.458 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.512 HG12 HD23 ' A' ' 107' ' ' LEU . 31.0 m -125.5 147.24 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 120.671 0.272 . . . . 62.21 111.599 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.38 149.59 50.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.876 0.369 . . . . 71.0 110.789 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.415 ' CD2' HG12 ' A' ' 105' ' ' ILE . 98.1 mt -102.16 137.18 40.76 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.591 0.589 . . . . 53.45 112.591 -172.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.8 mm -83.68 106.67 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.909 -0.587 . . . . 71.35 110.515 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.443 HD22 ' N ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER 62.09 64.35 1.86 Allowed Pre-proline 0 N--CA 1.476 0.862 0 CA-C-N 116.268 -0.424 . . . . 72.4 112.138 -178.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.98 128.86 6.7 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.62 2.214 . . . . 62.24 112.979 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.6 pt -135.06 127.48 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.962 0.41 . . . . 75.31 111.565 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.12 99.69 3.44 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.875 -0.417 . . . . 75.02 109.875 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.4 t70 . . . . . 0 CA--C 1.541 0.618 0 CA-C-O 121.298 0.57 . . . . 73.11 112.24 -171.259 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.573 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.245 0.823 0 N-CA-C 113.998 1.11 . . . . 73.34 113.998 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 70.6 m-85 -97.2 117.37 31.26 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.552 -1.204 . . . . 72.0 111.026 175.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 28.6 mt -95.92 105.47 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 121.18 0.514 . . . . 73.34 110.194 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -78.66 136.16 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.171 -0.468 . . . . 52.34 111.306 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.38 155.53 47.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.387 -0.37 . . . . 74.44 110.657 179.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -80.82 -23.64 39.06 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.55 0.214 . . . . 71.24 111.333 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -169.89 159.54 7.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.276 0.56 . . . . 63.0 111.741 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.478 HG13 HG21 ' A' ' 61' ' ' ILE . 37.0 mt -119.57 109.07 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.844 -0.616 . . . . 71.43 111.223 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.0 m -113.16 178.63 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 120.834 0.35 . . . . 72.35 111.084 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG12 ' A' ' 76' ' ' VAL . 96.1 mt -88.04 151.33 22.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.19 0.519 . . . . 75.21 111.331 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 110.138 -0.319 . . . . 73.53 110.138 176.417 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.451 ' HB2' HG23 ' A' ' 76' ' ' VAL . 99.1 mt . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 121.141 0.496 . . . . 54.54 110.57 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -101.85 105.64 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.189 0.519 . . . . 74.2 111.298 -175.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -58.6 135.49 57.37 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.409 -0.814 . . . . 73.35 112.651 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.6 m -113.17 -62.47 1.58 Allowed 'General case' 0 N--CA 1.471 0.615 0 O-C-N 122.039 -0.413 . . . . 73.25 111.529 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' H ' ' HB2' ' A' ' 47' ' ' ASP . . . -153.9 163.17 40.49 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.299 0.571 . . . . 62.42 112.104 -178.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 51.4 tp -74.81 111.8 10.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.319 -0.622 . . . . 50.41 109.319 171.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 13.4 tpt180 -63.54 -50.03 71.13 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.666 -0.243 . . . . 71.31 111.651 -172.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -176.74 147.58 0.63 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.531 0.567 . . . . 74.35 112.531 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.467 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 43.6 mt-10 -105.93 102.38 11.82 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.972 -0.558 . . . . 73.32 110.419 171.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -81.54 113.12 20.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 121.495 0.664 . . . . 63.31 110.267 174.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -101.1 157.1 17.02 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.138 -0.483 . . . . 64.24 110.681 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.2 mt -67.42 108.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.238 0.542 . . . . 53.45 111.741 -175.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -88.94 119.48 29.5 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.364 -0.38 . . . . 71.41 110.925 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.67 158.32 32.49 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.199 0.444 . . . . 74.2 112.199 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.37 -17.31 28.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.374 -0.375 . . . . 72.24 111.558 174.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.34 -4.79 35.53 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.327 -0.397 . . . . 64.11 111.851 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -28.66 10.3 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.318 -0.467 . . . . 22.23 113.181 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.2 m -81.98 153.64 26.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.057 0.456 . . . . 71.11 111.901 -178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.17 133.79 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.133 0.492 . . . . 71.14 111.404 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -84.03 167.33 16.96 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.334 0.588 . . . . 74.04 112.225 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.65 -25.07 64.63 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.758 -0.655 . . . . 64.21 110.72 176.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -76.4 131.33 39.05 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.848 -0.614 . . . . 61.51 111.623 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -94.72 149.0 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.417 -0.356 . . . . 61.2 110.765 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -92.92 -57.36 2.67 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.65 0.262 . . . . 75.31 111.23 -177.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' OE1' ' HE3' ' A' ' 101' ' ' LYS . 14.7 pt-20 -163.82 168.66 19.3 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.748 0.309 . . . . 72.4 111.22 176.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.527 ' HD3' HD13 ' A' ' 67' ' ' LEU . 45.6 mtt180 -128.18 125.63 39.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.565 0.579 . . . . 75.44 112.565 -174.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 28.9 m -100.05 133.29 44.66 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 116.035 -0.529 . . . . 71.22 112.091 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.59 151.6 35.88 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.076 0.55 . . . . 72.13 112.39 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.498 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 31.8 m-20 -91.24 107.62 19.33 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.048 -0.524 . . . . 71.43 111.276 171.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.427 HD12 HG21 ' A' ' 59' ' ' VAL . 77.0 mt -116.08 120.72 39.98 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.919 0.39 . . . . 73.4 110.724 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.726 ' NZ ' ' SD ' ' A' ' 56' ' ' MET . 71.7 mmtt -92.7 148.34 22.13 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.41 -0.359 . . . . 52.53 110.853 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.718 0.294 . . . . 51.42 111.568 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 120.596 0.236 . . . . 75.21 110.72 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.726 ' SD ' ' NZ ' ' A' ' 49' ' ' LYS . 21.4 ptt? -145.7 168.8 19.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.926 0.393 . . . . 44.3 111.664 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.56 134.52 46.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.009 -0.541 . . . . 73.15 110.749 176.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.37 105.37 17.45 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.905 0.383 . . . . 73.22 110.506 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 67.5 t -97.33 120.17 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 120.944 0.402 . . . . 71.11 111.927 -173.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 15.4 t -109.47 115.1 29.3 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.911 0.386 . . . . 42.15 111.61 -178.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -103.6 151.57 38.74 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 116.512 -0.313 . . . . 64.13 111.676 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.47 148.6 90.25 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.71 2.273 . . . . 73.11 113.303 -178.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -15.07 63.45 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.725 0.639 . . . . 61.41 112.725 -177.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 43.9 t -64.02 -20.58 66.01 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.981 0.42 . . . . 73.2 111.114 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.0 t -92.84 122.69 63.37 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.188 -0.46 . . . . 74.42 111.207 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.09 151.45 16.59 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.97 2.447 . . . . 71.54 113.637 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.527 HD13 ' HD3' ' A' ' 44' ' ' ARG . 28.7 tp -69.73 141.35 53.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.277 -0.419 . . . . 71.25 111.576 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -81.4 -57.63 3.4 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.028 0.751 . . . . 73.31 113.028 -170.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 59.5 41.86 18.51 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.263 0.468 . . . . 71.34 112.263 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.54 168.22 7.74 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.209 0.528 . . . . 54.42 111.651 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.89 153.35 43.39 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.495 -0.32 . . . . 72.02 110.911 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 59.0 t80 -62.64 119.05 8.49 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.795 0.331 . . . . 72.34 111.335 -178.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.44 ' N ' HD22 ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.54 19.8 5.0 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.246 0.618 . . . . 72.22 112.1 -178.159 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.77 141.21 58.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.088 0.47 . . . . 71.15 110.891 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 75' ' ' ARG . 29.4 mtp180 -72.94 112.65 9.17 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.932 -0.577 . . . . 74.43 111.128 -177.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.53 HG12 HD23 ' A' ' 107' ' ' LEU . 32.4 m -126.45 161.47 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.201 0.524 . . . . 71.34 111.891 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -143.02 154.26 43.81 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.014 0.435 . . . . 71.11 110.843 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.7 mt -95.3 142.66 27.44 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.527 0.565 . . . . 74.51 112.527 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.61 -77.58 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 CA-C-N 116.067 -0.515 . . . . 62.54 110.906 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -130.78 92.23 34.87 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.744 0.306 . . . . 72.41 111.173 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -82.68 156.94 16.11 Favored 'Trans proline' 0 CA--C 1.546 1.095 0 C-N-CA 123.246 2.631 . . . . 23.44 114.25 177.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 pt -145.46 132.87 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.332 0.653 . . . . 74.52 110.558 173.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.04 116.0 15.29 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.12 -0.363 . . . . 53.44 110.857 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.7 t70 . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 120.902 0.382 . . . . 73.52 111.733 -174.081 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.426 ' CH2' HD11 ' A' ' 100' ' ' ILE . 1.3 p-90 . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 121.274 0.559 . . . . 71.4 112.33 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -111.05 126.09 54.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 121.634 0.73 . . . . 74.42 112.737 -172.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 63.6 mt -116.51 125.1 73.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.557 -0.747 . . . . 75.41 110.937 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HE3' ' OE1' ' A' ' 43' ' ' GLU . 56.6 mtpt -90.39 143.14 27.04 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.723 -0.473 . . . . 71.13 109.723 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.95 164.0 29.38 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.054 0.761 . . . . 70.03 113.054 -174.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.3 -58.75 5.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.235 -0.893 . . . . 75.33 110.914 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -164.37 163.25 22.45 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.205 -0.452 . . . . 75.21 111.492 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 50.2 mt -120.02 124.76 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.083 -0.508 . . . . 74.2 111.189 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.2 m -123.34 179.29 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 122.282 -0.261 . . . . 74.33 111.291 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 76' ' ' VAL . 93.0 mt -81.04 151.76 28.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.856 0.36 . . . . 75.14 111.311 178.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 24.7 m . . . . . 0 N--CA 1.471 0.611 0 CA-C-O 120.898 0.38 . . . . 73.52 111.955 -179.031 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 109.588 -0.523 . . . . 75.44 109.588 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -125.71 129.37 49.4 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.49 0.662 . . . . 61.14 112.665 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -67.66 138.12 56.09 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.313 -0.858 . . . . 73.41 112.348 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.46 ' OG ' ' HD3' ' A' ' 49' ' ' LYS . 59.1 m -113.47 -64.7 1.27 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 111.893 0.331 . . . . 53.25 111.893 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.43 168.97 24.0 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.293 0.568 . . . . 74.31 112.393 -177.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.41 HD21 ' HG3' ' A' ' 27' ' ' GLU . 64.8 tp -81.41 112.09 18.36 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.57 -0.741 . . . . 70.13 110.278 172.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -68.51 -52.64 29.94 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.81 0.338 . . . . 61.35 111.34 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -175.56 134.84 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.058 0.392 . . . . 64.23 112.058 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.532 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.3 mt-10 -93.16 98.41 11.28 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.895 -0.409 . . . . 73.45 109.895 169.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.5 m -70.41 128.08 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.968 0.414 . . . . 72.04 110.752 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 41' ' ' ILE . 62.6 mtt180 -100.96 168.6 9.51 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.564 0.697 . . . . 73.35 112.804 -175.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.92 112.43 10.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.312 -0.858 . . . . 71.4 111.116 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.5 tt0 -84.96 115.0 22.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.861 0.362 . . . . 73.33 111.081 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -55.76 144.9 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.195 -0.457 . . . . 52.42 111.217 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -55.49 -24.01 29.09 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.365 0.505 . . . . 60.12 112.365 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.76 -37.9 74.45 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.007 0.432 . . . . 74.4 111.552 173.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.52 -17.24 5.57 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.35 -0.453 . . . . 53.31 113.098 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.4 m -94.77 148.83 21.88 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.31 -0.523 . . . . 74.33 111.754 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.581 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 34.1 t -82.38 143.62 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 120.949 0.404 . . . . 71.42 111.794 -177.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -94.02 178.84 5.52 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.037 0.446 . . . . 52.14 111.771 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -85.07 -21.42 29.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.3 -0.409 . . . . 64.45 111.29 177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -69.74 136.63 51.18 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.474 -0.33 . . . . 74.35 110.805 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 29' ' ' ARG . 50.7 mt -90.39 144.73 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.339 0.59 . . . . 74.23 111.858 -175.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.513 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 28.9 tptp -97.9 -59.18 1.82 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.626 -0.715 . . . . 42.43 110.904 179.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.513 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.9 mt-10 -145.92 170.21 17.05 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.993 0.425 . . . . 75.42 111.089 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 54.5 mtt180 -128.1 119.05 24.55 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.778 0.431 . . . . 53.21 111.367 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 62.9 m -100.99 131.42 46.88 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.27 0.47 . . . . 63.21 112.27 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.482 ' OH ' HD12 ' A' ' 67' ' ' LEU . 39.6 m-85 -125.08 156.33 38.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.719 0.407 . . . . 72.32 111.38 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -99.97 123.04 43.78 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.693 -0.23 . . . . 71.34 111.413 173.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.499 HD12 HG21 ' A' ' 59' ' ' VAL . 51.6 mt -119.72 130.21 54.89 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.805 0.336 . . . . 75.43 111.498 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.507 ' HE3' ' SD ' ' A' ' 56' ' ' MET . 14.3 mptt -80.83 115.54 20.37 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.624 0.249 . . . . 75.35 110.834 173.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 120.679 0.276 . . . . 74.33 111.187 177.387 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 120.982 0.42 . . . . 72.51 111.708 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.507 ' SD ' ' HE3' ' A' ' 49' ' ' LYS . 63.8 mtm -93.56 107.73 19.55 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.638 -0.505 . . . . 71.41 109.638 168.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.457 HD12 HD12 ' A' ' 100' ' ' ILE . 24.2 pt -94.71 134.83 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.465 0.174 . . . . 64.13 111.393 -174.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -90.6 104.94 17.46 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 75.4 111.204 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 91.9 t -96.59 128.37 47.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.91 -0.587 . . . . 75.12 111.31 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.624 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 48.9 m -123.08 137.82 54.83 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 65.02 111.891 -176.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 pt -124.42 147.81 56.43 Favored Pre-proline 0 N--CA 1.472 0.671 0 CA-C-N 116.213 -0.449 . . . . 63.34 110.798 177.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.36 150.54 86.82 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.298 1.999 . . . . 72.42 112.482 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.13 -32.94 37.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.763 0.653 . . . . 64.15 112.763 -176.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.8 m -53.46 -32.81 51.69 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.233 0.457 . . . . 71.42 112.233 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -82.08 116.15 61.73 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.616 -0.265 . . . . 43.52 110.748 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -49.74 141.43 27.67 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.163 2.575 . . . . 73.41 113.755 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.57 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 31.6 tp -52.63 138.0 29.44 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.302 -0.408 . . . . 50.24 110.844 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.523 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 24.7 mmmt -79.97 -57.55 3.59 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.621 0.6 . . . . 74.24 112.621 -170.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.57 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 39.2 mt-10 57.86 39.57 26.74 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 112.592 0.59 . . . . 64.13 112.592 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -70.66 172.69 8.23 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.168 0.508 . . . . 74.31 112.056 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.577 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 5.8 m-20 -70.17 157.72 37.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.381 0.61 . . . . 65.22 112.084 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.425 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 7.6 t80 -70.66 117.38 12.11 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.793 -0.639 . . . . 72.35 110.902 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 46.9 m-80 74.92 21.82 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.592 0.757 . . . . 64.43 112.069 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.577 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -74.95 141.63 44.04 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.963 0.357 . . . . 51.4 111.963 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 70.7 mtm180 -67.45 116.16 7.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.599 -0.273 . . . . 71.01 110.717 178.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.52 140.03 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-O 121.042 0.449 . . . . 75.41 112.171 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.431 ' HG3' HG23 ' A' ' 106' ' ' VAL . 8.1 pt-20 -124.53 157.16 35.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.232 0.539 . . . . 64.15 111.025 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.95 132.13 45.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.262 -0.427 . . . . 72.0 111.777 -176.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.585 HG22 ' ND2' ' A' ' 80' ' ' ASN . 50.0 mm -63.62 -72.61 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 116.28 -0.418 . . . . 64.54 111.364 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.585 ' ND2' HG22 ' A' ' 79' ' ' ILE . 41.0 m-80 -125.32 89.96 51.64 Favored Pre-proline 0 N--CA 1.476 0.858 0 CA-C-O 120.573 0.225 . . . . 52.23 110.452 174.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.87 147.7 15.24 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.202 2.601 . . . . 64.22 114.352 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 101' ' ' LYS . 38.4 pt -140.04 149.14 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.967 0.413 . . . . 72.44 110.78 172.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.14 116.51 28.87 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.916 0.388 . . . . 70.25 110.816 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.536 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . 17.9 t70 . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 121.479 0.657 . . . . 74.12 112.442 -174.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.965 0 CA-C-O 122.545 1.164 . . . . 72.31 113.982 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -110.39 122.27 47.28 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.25 -1.341 . . . . 75.34 111.094 178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 34.6 mt -105.27 104.63 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.085 0.469 . . . . 73.44 110.46 177.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.624 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 50.3 mtpt -87.42 130.26 34.73 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.997 -0.44 . . . . 71.33 111.17 -176.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.12 157.93 31.81 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.651 0.611 . . . . 50.55 112.651 -173.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 28.9 t70 -66.95 -38.37 86.01 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.469 -0.787 . . . . 64.42 111.294 175.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -169.8 161.08 8.98 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.168 -0.469 . . . . 72.54 110.951 176.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.523 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 42.3 mt -119.28 120.98 65.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.148 -0.478 . . . . 63.24 110.883 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.431 HG23 ' HG3' ' A' ' 77' ' ' GLU . 27.8 m -120.42 -179.65 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 122.218 -0.301 . . . . 44.43 111.105 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.5 128.47 35.23 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.944 0.402 . . . . 63.33 111.901 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.492 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 26.4 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.429 0.633 . . . . 65.34 111.234 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 50' ' ' SER . 97.2 mt . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.804 0.335 . . . . 74.24 111.222 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -102.62 139.06 38.7 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.987 0.423 . . . . 51.22 111.21 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 67.5 t80 -71.98 102.06 2.85 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.275 -0.421 . . . . 71.24 110.581 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.552 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.3 t -73.29 -64.83 0.9 Allowed 'General case' 0 N--CA 1.472 0.625 0 O-C-N 122.018 -0.426 . . . . 71.01 111.864 -175.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.57 171.67 17.65 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.608 0.596 . . . . 75.43 112.608 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.451 HD13 ' CE2' ' A' ' 46' ' ' TYR . 37.1 tp -90.06 105.83 18.07 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.853 -0.612 . . . . 73.11 109.486 169.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 25' ' ' ARG . 16.0 tpt180 -65.82 -53.14 43.96 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.487 -0.324 . . . . 75.41 111.546 -175.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -177.01 141.21 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.247 0.462 . . . . 74.23 112.247 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.41 98.89 11.51 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.647 -0.501 . . . . 71.02 109.647 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 42' ' ' LYS . 31.9 m -78.16 144.78 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-O 121.303 0.573 . . . . 74.5 111.773 -174.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm180 -109.56 168.35 9.46 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.949 -0.569 . . . . 65.21 112.109 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.0 mt -80.99 141.78 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.977 -0.556 . . . . 61.54 111.164 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -95.45 150.74 19.96 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.088 0.471 . . . . 72.13 111.707 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -93.55 155.45 17.3 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.489 -0.323 . . . . 62.51 110.427 174.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -62.19 -21.34 65.02 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.216 0.532 . . . . 74.43 111.344 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.54 -31.89 70.97 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.917 -0.583 . . . . 62.25 111.582 172.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.53 -34.86 4.47 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 116.222 -0.444 . . . . 51.34 112.156 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.7 m -68.14 153.92 42.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.004 0.431 . . . . 74.2 111.319 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -87.28 146.33 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 120.819 0.343 . . . . 73.43 111.5 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.9 t -90.53 172.4 8.73 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.213 0.53 . . . . 72.24 112.208 -179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -81.07 -15.54 55.72 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.998 -0.546 . . . . 63.32 110.628 173.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.08 135.87 56.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.817 -0.629 . . . . 74.3 110.75 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.93 142.96 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-O 120.929 0.395 . . . . 73.34 111.266 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HG23 ' A' ' 28' ' ' VAL . 29.1 tptp -98.31 -58.26 2.01 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.955 0.407 . . . . 55.2 111.267 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -164.4 166.44 20.65 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.089 0.471 . . . . 71.43 111.291 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 60' ' ' SER . 38.3 mtt180 -114.5 114.39 25.73 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.001 0.371 . . . . 75.33 112.001 -173.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.0 m -91.64 126.92 36.89 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.169 -0.469 . . . . 64.33 112.055 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CE2' HD13 ' A' ' 24' ' ' LEU . 92.8 m-85 -123.61 151.75 42.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.209 0.604 . . . . 73.21 111.527 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 22' ' ' SER . 69.5 m-20 -102.08 119.27 38.53 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.938 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.642 HD12 HG21 ' A' ' 59' ' ' VAL . 39.6 mt -114.55 141.22 48.02 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.987 0.422 . . . . 75.51 111.922 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HG2' ' HB2' ' A' ' 22' ' ' SER . 29.0 mmmt -96.21 124.54 40.25 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.0 -0.545 . . . . 73.1 111.121 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HA ' HD23 ' A' ' 19' ' ' LEU . 29.1 t . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 120.894 0.378 . . . . 52.3 111.477 177.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 . . . . . 0 CA--C 1.537 0.473 0 CA-C-O 121.27 0.557 . . . . 62.05 111.448 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.0 OUTLIER -110.16 131.25 55.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.897 -0.592 . . . . 63.52 110.904 175.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 100' ' ' ILE . 24.4 pt -115.02 142.99 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 116.523 -0.308 . . . . 64.42 111.359 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.2 mp0 -89.99 104.99 17.5 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.82 0.343 . . . . 71.14 110.572 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.642 HG21 HD12 ' A' ' 48' ' ' LEU . 87.2 t -100.6 129.94 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.079 -0.388 . . . . 70.54 111.424 -178.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.496 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 38.2 t -127.7 151.14 49.34 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.336 0.589 . . . . 62.43 112.275 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.9 pt -134.42 141.04 37.56 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 115.861 -0.609 . . . . 72.4 110.609 176.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.425 ' HG2' HG23 ' A' ' 65' ' ' VAL . 15.5 Cg_endo -56.35 152.25 40.25 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.4 2.067 . . . . 74.24 112.936 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.59 -30.12 19.82 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.301 0.852 . . . . 73.3 113.301 -177.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.5 p -67.26 -20.26 65.63 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.412 0.523 . . . . 64.53 112.412 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.425 HG23 ' HG2' ' A' ' 62' ' ' PRO . 53.2 t -84.78 132.27 46.79 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 120.536 0.208 . . . . 61.01 111.37 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.04 158.98 8.14 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.114 2.543 . . . . 74.14 113.818 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.5 tp -76.0 129.65 37.2 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.954 -0.566 . . . . 63.21 111.77 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 0.0 OUTLIER -86.88 123.46 32.04 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.113 0.482 . . . . 70.42 111.366 174.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -116.72 49.28 1.18 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.715 -0.675 . . . . 71.4 111.397 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -84.4 177.01 8.31 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.948 0.722 . . . . 72.5 112.948 -174.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.3 159.25 15.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.553 -0.749 . . . . 71.31 111.624 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.615 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.1 t80 -59.86 -35.35 74.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.298 0.481 . . . . 74.22 112.298 -179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.432 ' ND2' ' HD2' ' A' ' 72' ' ' TYR . 5.5 m120 -93.73 2.65 56.21 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 122.133 -0.355 . . . . 35.4 111.474 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.17 135.04 42.81 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.015 0.436 . . . . 62.23 111.802 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -79.53 126.42 30.85 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.166 -0.47 . . . . 54.31 110.327 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.2 m -129.28 142.45 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.284 0.564 . . . . 72.0 112.516 -178.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.25 170.53 14.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.928 -0.578 . . . . 64.13 110.773 177.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.3 133.36 55.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.866 0.365 . . . . 71.12 111.923 -176.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.591 HG22 ' ND2' ' A' ' 80' ' ' ASN . 50.1 mm -64.97 -65.58 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.158 -0.474 . . . . 63.12 111.645 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.591 ' ND2' HG22 ' A' ' 79' ' ' ILE . 56.2 m-80 -129.04 89.24 49.18 Favored Pre-proline 0 N--CA 1.474 0.744 0 O-C-N 122.18 -0.325 . . . . 63.51 110.669 174.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.04 141.7 13.26 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.927 2.418 . . . . 72.32 114.07 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.5 pt -133.34 129.66 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.982 0.42 . . . . 63.43 110.787 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.86 114.26 8.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.865 0.364 . . . . 43.25 110.825 175.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 CA--C 1.539 0.531 0 CA-C-O 121.447 0.641 . . . . 71.42 111.878 -176.302 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.41 ' CH2' HD11 ' A' ' 100' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 N-CA-C 114.618 1.34 . . . . 63.03 114.618 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.508 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 51.6 m-85 -110.95 136.66 49.63 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.766 -1.561 . . . . 75.14 111.34 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 57' ' ' ILE . 51.1 mt -114.72 105.5 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.182 0.515 . . . . 72.32 109.62 171.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.506 ' O ' HG12 ' A' ' 82' ' ' ILE . 38.0 mtmt -96.19 133.1 40.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.996 0.427 . . . . 74.4 111.09 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.38 158.44 26.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.464 0.649 . . . . 72.14 112.702 -172.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 19.9 t70 -59.58 -37.48 78.61 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.263 -0.881 . . . . 71.31 110.976 171.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -170.7 152.86 3.88 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.787 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.416 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 68.0 mt -108.93 118.82 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.767 -0.652 . . . . 74.34 110.953 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -127.16 164.69 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 121.038 0.447 . . . . 71.15 112.071 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 90.6 mt -76.81 137.64 39.35 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.39 0.614 . . . . 73.01 112.236 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 5.1 m . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 115.924 -0.58 . . . . 75.01 110.375 174.756 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.4 mt . . . . . 0 N--CA 1.464 0.252 0 N-CA-C 110.055 -0.35 . . . . 75.4 110.055 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -102.79 123.31 46.23 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.302 0.573 . . . . 64.53 112.198 -176.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -67.49 143.57 56.12 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.253 -0.885 . . . . 61.5 111.456 -179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -123.53 -62.94 1.27 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.792 0.294 . . . . 72.52 111.792 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.61 164.14 36.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.248 0.547 . . . . 65.34 112.327 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.61 115.04 9.32 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.888 -0.596 . . . . 75.42 110.707 173.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 8.4 tpt180 -73.04 -59.72 2.57 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.948 0.404 . . . . 71.35 111.493 -176.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -161.92 139.68 8.82 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.043 0.386 . . . . 70.2 112.043 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -99.8 99.96 10.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.396 -0.594 . . . . 73.24 109.396 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' HB2' ' A' ' 42' ' ' LYS . 16.0 m -68.19 87.98 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.784 0.802 . . . . 63.43 111.254 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 46.8 mtt180 -82.07 155.91 24.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.884 -0.598 . . . . 61.12 111.825 -176.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.651 HG12 ' HE2' ' A' ' 42' ' ' LYS . 54.2 mt -68.63 107.47 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 115.862 -0.608 . . . . 70.41 111.829 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.45 112.61 20.53 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.034 0.445 . . . . 64.03 110.227 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -60.04 164.72 3.79 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.798 -0.637 . . . . 61.54 112.51 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.2 -32.07 64.05 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.304 0.573 . . . . 72.42 110.911 176.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.24 -8.22 43.89 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.633 -0.712 . . . . 74.32 111.865 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.04 -3.49 82.62 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.231 -0.509 . . . . 73.12 113.027 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.4 p -84.15 155.21 22.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.859 0.361 . . . . 71.21 111.479 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 43.9 t -95.74 124.31 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.885 0.374 . . . . 75.32 111.563 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 t -85.7 152.72 22.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.353 -0.385 . . . . 60.01 111.446 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.85 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.937 0.398 . . . . 64.14 111.029 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.85 143.05 58.2 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.244 0.545 . . . . 71.32 111.806 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 31.1 mt -113.06 145.93 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 116.192 -0.458 . . . . 73.05 111.672 -175.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HE2' HG12 ' A' ' 30' ' ' ILE . 73.9 mmtt -78.76 -50.66 10.99 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.233 0.539 . . . . 52.31 110.176 170.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.84 168.18 8.93 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.732 -0.667 . . . . 74.34 111.404 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.3 mtt180 -114.87 117.19 29.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.694 0.398 . . . . 74.34 112.032 -173.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.1 m -96.32 132.42 41.82 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.338 -0.392 . . . . 74.32 111.788 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -122.97 153.97 39.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.679 0.391 . . . . 62.22 111.659 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.424 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 61.4 m-20 -88.48 113.17 23.78 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.693 0.282 . . . . 64.3 111.664 175.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 59' ' ' VAL . 67.5 mt -113.19 122.14 46.6 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.011 0.434 . . . . 75.23 110.865 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HE2' ' HG3' ' A' ' 56' ' ' MET . 1.1 mptm? -94.5 141.12 28.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.094 0.474 . . . . 74.32 112.076 -178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.45 ' HB2' ' HG2' ' A' ' 55' ' ' ARG . 19.6 m . . . . . 0 N--CA 1.472 0.637 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.514 175.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.45 ' HG2' ' HB2' ' A' ' 50' ' ' SER . 15.8 ptt180 . . . . . 0 N--CA 1.471 0.612 0 CA-C-O 121.213 0.53 . . . . 72.22 111.86 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.474 ' SD ' ' N ' ' A' ' 56' ' ' MET . 3.3 mpp? -111.8 108.4 17.79 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.824 -0.625 . . . . 74.11 110.055 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.5 pt -98.1 144.71 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.715 0.293 . . . . 72.0 111.091 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 87.4 mm-40 -97.48 105.05 17.13 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.055 0.455 . . . . 75.42 110.973 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.615 HG21 HD12 ' A' ' 48' ' ' LEU . 98.9 t -107.19 128.31 62.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 116.442 -0.345 . . . . 74.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 31.5 t -126.46 134.72 50.88 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.295 0.48 . . . . 63.33 112.295 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.6 pt -115.13 143.98 31.27 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 116.271 -0.422 . . . . 74.11 111.192 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.65 147.38 60.1 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.585 2.19 . . . . 74.1 113.193 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.03 -16.89 20.75 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.057 0.762 . . . . 45.44 113.057 -176.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 m -74.96 -4.53 38.73 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.025 0.38 . . . . 41.41 112.025 177.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.8 t -102.19 131.43 22.62 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 122.487 0.315 . . . . 74.4 111.201 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.99 146.03 17.91 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.003 2.468 . . . . 75.51 113.869 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.01 136.83 50.81 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.939 -0.573 . . . . 74.42 111.686 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -87.68 133.2 33.88 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.168 0.508 . . . . 75.42 112.12 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -117.9 30.92 6.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.644 -0.707 . . . . 64.3 111.161 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -64.54 161.39 17.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.637 0.606 . . . . 75.24 112.637 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -83.49 163.58 20.38 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.636 -0.711 . . . . 53.1 112.102 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -64.17 120.92 13.02 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.25 -0.432 . . . . 74.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 66.4 34.3 6.38 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 64.12 111.865 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.58 118.68 20.22 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.471 -0.331 . . . . 71.43 111.198 175.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -60.11 108.87 0.84 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.877 0.37 . . . . 63.43 111.663 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.483 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.85 169.75 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.407 0.622 . . . . 74.05 111.817 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.87 157.96 44.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.043 -0.526 . . . . 61.24 110.697 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 93.5 mt -102.65 126.55 49.79 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.944 0.35 . . . . 45.22 111.944 -175.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.621 HG22 ' ND2' ' A' ' 80' ' ' ASN . 50.2 mm -56.13 -59.99 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 116.266 -0.424 . . . . 73.33 111.622 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.621 ' ND2' HG22 ' A' ' 79' ' ' ILE . 61.0 m-80 -137.03 91.56 14.82 Favored Pre-proline 0 N--CA 1.473 0.702 0 O-C-N 122.237 -0.289 . . . . 52.15 111.257 174.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.75 141.47 12.18 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.019 2.479 . . . . 73.51 113.615 176.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -141.78 131.26 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-O 121.042 0.449 . . . . 73.32 111.231 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.34 110.11 9.42 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.227 -0.296 . . . . 74.42 110.457 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.6 t70 . . . . . 0 CA--C 1.549 0.914 0 C-N-CA 121.2 -0.2 . . . . 74.32 111.264 -171.916 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 . . . . . 0 C--O 1.243 0.745 0 CA-C-O 121.384 0.612 . . . . 53.45 111.858 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.437 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -112.67 126.65 55.62 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.54 -0.755 . . . . 65.23 112.946 -171.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.429 ' HB ' HG22 ' A' ' 59' ' ' VAL . 57.3 mt -111.07 115.93 51.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.197 -0.91 . . . . 54.13 110.291 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -84.8 134.85 34.3 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.078 -0.389 . . . . 75.34 110.898 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.1 143.96 50.92 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.227 0.537 . . . . 54.02 112.165 -176.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.0 t70 -65.01 -40.03 94.31 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.884 -0.598 . . . . 72.21 111.422 176.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.453 ' HB3' HG13 ' A' ' 79' ' ' ILE . 22.1 t0 -170.42 161.61 8.03 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 116.383 -0.371 . . . . 75.53 110.817 178.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 36.5 mt -122.66 122.13 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 116.527 -0.306 . . . . 74.12 111.302 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.7 m -126.35 176.57 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.64 0.257 . . . . 72.33 111.026 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.483 HD23 HG12 ' A' ' 76' ' ' VAL . 97.2 mt -76.05 145.41 40.17 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.176 -0.327 . . . . 63.14 111.417 177.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.595 0.236 . . . . 61.05 110.873 177.764 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.6 mt . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 110.094 -0.336 . . . . 53.53 110.094 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD2' ' O ' ' A' ' 73' ' ' ASN . 46.9 mtmt -132.83 138.81 47.2 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 122.036 -0.415 . . . . 73.31 112.027 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -70.2 140.03 52.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.057 0.391 . . . . 70.33 112.057 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 94.8 p -125.97 -62.39 1.18 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.011 0.374 . . . . 75.13 112.011 177.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -149.98 -173.6 4.48 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.494 0.553 . . . . 73.32 112.494 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 tp -104.85 123.79 48.32 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.237 -0.438 . . . . 74.14 110.754 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -73.16 -64.75 0.91 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.095 0.406 . . . . 73.5 112.095 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -170.16 143.45 2.44 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.071 0.462 . . . . 72.12 111.905 -174.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.433 ' HG2' ' HG3' ' A' ' 44' ' ' ARG . 43.3 mt-10 -106.13 108.96 20.75 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.18 -0.464 . . . . 74.53 110.481 173.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -85.95 110.05 19.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 121.304 0.573 . . . . 64.23 111.17 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.682 ' HG2' HG12 ' A' ' 41' ' ' ILE . 73.7 mtm180 -99.9 178.48 4.8 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.474 0.654 . . . . 63.12 112.761 -174.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.06 124.17 39.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.496 -0.774 . . . . 71.5 110.639 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -98.35 133.78 42.28 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.999 0.428 . . . . 74.43 111.698 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -68.94 143.72 54.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.249 -0.432 . . . . 72.41 110.741 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.59 -17.68 48.02 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.139 0.495 . . . . 75.11 111.636 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.12 -39.75 71.86 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.069 0.461 . . . . 75.03 111.253 174.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.5 -46.22 0.82 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.372 -0.442 . . . . 73.44 112.916 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.2 p -61.46 160.79 10.42 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 120.991 0.424 . . . . 35.53 111.931 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.4 t -107.97 136.89 41.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-O 121.024 0.44 . . . . 75.11 111.793 -177.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 t -79.83 168.88 18.7 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.272 0.558 . . . . 73.44 111.895 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.42 -26.74 55.82 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.206 -0.452 . . . . 71.11 111.813 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 142.69 57.94 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.268 0.556 . . . . 53.54 111.453 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.682 HG12 ' HG2' ' A' ' 29' ' ' ARG . 24.1 mt -115.48 145.04 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 116.066 -0.516 . . . . 54.25 111.934 -172.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -78.58 -57.79 3.59 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.146 0.498 . . . . 72.44 110.389 173.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.44 167.75 25.02 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.157 0.503 . . . . 64.4 111.478 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.433 ' HG3' ' HG2' ' A' ' 27' ' ' GLU . 44.8 ttm180 -125.51 123.71 39.76 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.927 0.394 . . . . 72.35 111.752 -172.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 16.9 m -102.3 128.84 48.68 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 116.2 -0.455 . . . . 75.5 112.175 -177.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -109.9 160.26 16.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.71 0.404 . . . . 74.32 111.369 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.05 124.1 42.39 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.476 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.439 ' HB2' HG13 ' A' ' 57' ' ' ILE . 73.3 mt -123.52 130.32 52.51 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.151 0.5 . . . . 74.23 111.535 178.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.418 ' NZ ' ' HB3' ' A' ' 49' ' ' LYS . 1.8 mmmp? -80.77 128.57 33.79 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.444 -0.344 . . . . 75.43 110.64 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 112.235 0.458 . . . . 61.22 112.235 -175.546 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 120.825 0.345 . . . . 71.11 110.935 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -108.55 177.62 4.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.691 0.281 . . . . 72.43 110.492 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.439 HG13 ' HB2' ' A' ' 48' ' ' LEU . 36.4 pt -131.62 138.24 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.962 0.41 . . . . 44.44 111.81 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -104.74 105.68 15.86 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.033 0.444 . . . . 74.11 110.622 175.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 93.5 t -100.07 126.59 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.308 0.484 . . . . 51.2 112.308 -173.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 14.3 t -114.03 123.07 48.78 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.712 0.291 . . . . 65.02 111.749 -176.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 pt -114.03 155.1 45.85 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.543 -0.299 . . . . 74.32 111.368 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.27 138.73 80.23 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 122.778 2.319 . . . . 73.24 113.297 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.74 -13.81 62.43 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.668 0.618 . . . . 73.12 112.668 -176.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.1 m -73.83 0.67 12.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 120.938 0.399 . . . . 71.52 111.169 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 94.5 t -101.77 129.96 25.52 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 122.816 0.446 . . . . 74.23 110.849 176.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.46 156.18 27.5 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.658 2.239 . . . . 74.12 113.438 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.553 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 39.7 tp -69.45 145.75 52.53 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.088 -0.506 . . . . 71.11 111.563 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.488 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 13.5 mptt -93.62 -66.13 0.94 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.986 0.736 . . . . 51.33 112.986 -176.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.1 mt-10 60.88 49.28 6.09 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.861 0.319 . . . . 65.44 111.861 -177.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.51 176.41 1.11 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.479 0.657 . . . . 63.31 112.644 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 16.7 m-20 -71.77 153.85 41.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.703 -0.68 . . . . 73.33 111.843 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -67.49 119.57 12.52 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.95 -0.568 . . . . 70.23 111.263 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 40.5 m-80 61.97 34.33 16.8 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.584 0.587 . . . . 74.32 112.584 -177.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -88.03 142.18 27.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.719 -0.219 . . . . 73.02 111.142 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -62.18 115.96 4.58 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.383 0.611 . . . . 63.5 112.388 179.837 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HD23 ' A' ' 107' ' ' LEU . 33.5 m -125.31 146.94 30.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.587 -0.733 . . . . 71.42 111.208 177.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -125.65 162.99 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.313 0.577 . . . . 73.22 111.316 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 59' ' ' VAL . 86.7 mt -110.17 137.67 47.59 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.226 -0.443 . . . . 75.22 111.731 -176.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -67.11 -68.42 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 116.286 -0.416 . . . . 65.11 110.925 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 102' ' ' ALA . 80.9 m-20 -122.72 85.99 49.56 Favored Pre-proline 0 N--CA 1.473 0.693 0 CA-C-N 116.679 -0.237 . . . . 75.02 111.191 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.73 129.81 6.52 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.808 2.339 . . . . 64.43 113.449 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.8 pt -137.86 130.97 41.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 121.162 0.506 . . . . 70.23 111.046 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.66 127.65 32.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.775 0.321 . . . . 72.51 111.425 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 112.152 0.427 . . . . 72.51 112.152 -178.709 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 . . . . . 0 CA--C 1.543 0.699 0 CA-C-O 121.651 0.739 . . . . 73.53 112.607 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.2 138.93 34.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.483 -0.78 . . . . 63.12 112.061 -178.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 50.5 mt -124.67 114.64 41.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 115.724 -0.671 . . . . 74.2 110.142 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -83.4 139.12 33.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.068 -0.395 . . . . 64.21 110.387 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 80' ' ' ASN . . . -141.16 160.49 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.29 0.566 . . . . 54.04 112.39 -175.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.426 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 34.7 t70 -63.01 -55.39 26.04 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.606 -0.725 . . . . 60.11 110.986 175.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -163.19 164.85 25.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.11 -0.495 . . . . 74.24 110.896 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.488 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 52.3 mt -115.04 117.34 55.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.087 0.555 . . . . 74.22 111.234 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.34 175.28 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.154 -0.341 . . . . 74.54 111.425 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.401 HD23 HG12 ' A' ' 76' ' ' VAL . 96.4 mt -77.12 138.13 39.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.723 0.297 . . . . 74.22 111.45 178.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.5 m . . . . . 0 N--CA 1.469 0.525 0 CA-C-O 120.902 0.382 . . . . 60.43 111.758 -179.124 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 95.3 mt . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 120.773 0.32 . . . . 63.3 110.58 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HB2' ' HD3' ' A' ' 49' ' ' LYS . 57.6 mttp -112.78 130.77 55.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.911 0.386 . . . . 61.41 111.387 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.85 132.39 48.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.92 -0.582 . . . . 63.12 111.207 177.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 m -116.75 -64.31 1.33 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.894 0.378 . . . . 72.52 111.607 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.68 -175.41 5.14 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.06 0.457 . . . . 70.44 111.894 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -105.89 107.24 18.14 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.166 -0.47 . . . . 72.4 110.127 175.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -59.01 -52.88 63.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.547 0.573 . . . . 73.33 112.547 -174.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -174.42 134.93 0.41 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.77 0.656 . . . . 51.22 112.77 -174.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -105.18 106.16 16.53 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.34 -0.391 . . . . 73.04 110.351 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -78.36 113.1 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.066 0.46 . . . . 72.33 111.505 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.645 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 96.0 mtt180 -79.95 161.96 25.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.278 0.561 . . . . 74.55 112.375 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -77.01 105.5 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 115.721 -0.672 . . . . 74.0 111.267 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.437 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 64.4 tt0 -77.85 121.18 23.76 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.891 0.377 . . . . 72.44 111.23 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -65.84 147.21 53.74 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.942 0.401 . . . . 74.11 111.574 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -63.33 -13.96 44.66 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.122 -0.49 . . . . 74.2 111.465 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.51 -23.93 61.08 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.049 0.452 . . . . 74.32 111.342 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.75 -42.87 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.442 -0.408 . . . . 72.21 112.97 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.0 m -74.5 159.88 31.66 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.093 0.473 . . . . 73.12 111.903 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 50.1 t -92.59 137.08 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.889 0.376 . . . . 55.33 111.527 -178.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.8 t -79.64 179.67 7.37 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.396 0.617 . . . . 73.34 111.884 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -78.49 -44.95 23.23 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.034 -0.53 . . . . 74.21 110.997 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -72.82 157.6 37.16 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.244 0.831 . . . . 62.52 113.244 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 34.2 mt -104.06 152.44 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.442 -0.799 . . . . 53.33 111.699 -176.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -91.95 -58.34 2.43 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.045 0.45 . . . . 73.53 111.254 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -153.97 160.66 42.16 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 120.882 0.372 . . . . 65.11 111.217 176.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 44' ' ' ARG . 5.5 ptp85 -125.63 126.44 44.73 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.563 0.579 . . . . 54.3 112.563 -174.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 88.8 m -96.6 129.12 44.05 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.735 -0.666 . . . . 65.32 111.991 -178.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' OH ' HD12 ' A' ' 67' ' ' LEU . 66.1 m-85 -107.82 163.53 13.04 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 121.23 0.538 . . . . 71.3 112.138 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -106.94 108.35 19.82 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.58 -0.736 . . . . 73.52 111.472 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.9 mt -122.64 125.92 46.6 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 122.29 -0.256 . . . . 74.41 110.895 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HD3' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -94.11 134.48 36.5 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.87 -0.518 . . . . 70.44 112.022 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.472 0.664 0 CA-C-N 116.149 -0.478 . . . . 71.05 111.442 -178.789 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 . . . . . 0 N--CA 1.469 0.477 0 CA-C-O 121.195 0.521 . . . . 73.12 111.942 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.476 ' SD ' ' N ' ' A' ' 56' ' ' MET . 1.5 pmm? -102.14 147.69 26.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.857 -0.611 . . . . 72.31 111.377 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.8 pt -103.52 137.82 30.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.025 177.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -93.45 104.68 16.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.182 -0.463 . . . . 70.42 110.394 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -105.36 112.43 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.813 0.34 . . . . 64.31 111.728 -175.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 98.2 p -103.91 130.74 51.54 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.269 0.557 . . . . 72.32 111.874 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -125.21 152.36 70.81 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 116.127 -0.488 . . . . 74.21 111.095 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.78 142.54 41.38 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.716 2.277 . . . . 73.4 113.508 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.52 -30.81 69.97 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.925 0.393 . . . . 52.14 111.966 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.9 t -61.08 -22.74 64.9 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.087 0.47 . . . . 74.44 111.306 176.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.83 127.81 84.76 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 116.462 -0.336 . . . . 55.33 110.547 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.38 144.01 92.56 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.917 2.411 . . . . 74.43 113.741 -175.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.441 HD12 ' OH ' ' A' ' 46' ' ' TYR . 24.3 tp -60.45 146.71 43.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.468 -0.787 . . . . 63.3 110.608 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 68' ' ' LYS . 3.6 mptp? -88.09 -56.79 3.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.95 0.722 . . . . 63.21 112.95 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 59.65 21.95 10.65 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.569 0.581 . . . . 73.03 112.569 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.21 164.98 14.64 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.2 0.524 . . . . 51.43 112.172 -177.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -65.1 146.91 54.37 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.432 0.634 . . . . 60.31 112.568 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.09 123.94 19.49 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.434 -0.803 . . . . 73.44 111.627 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.0 m120 71.03 16.71 6.36 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.21 0.604 . . . . 64.43 112.53 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.21 149.06 32.03 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.149 -0.344 . . . . 75.11 111.09 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.56 123.85 22.38 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.911 0.386 . . . . 74.52 111.427 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.462 HG12 HD23 ' A' ' 107' ' ' LEU . 30.4 m -127.21 140.47 49.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 121.052 0.453 . . . . 63.14 111.075 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -123.73 153.33 41.04 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.202 0.525 . . . . 72.51 111.151 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.422 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.7 mt -93.61 146.46 23.8 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.195 -0.457 . . . . 71.55 111.732 -177.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.534 HG22 ' ND2' ' A' ' 80' ' ' ASN . 49.6 mm -77.0 -67.32 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.24 -0.436 . . . . 62.23 111.005 176.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.534 ' ND2' HG22 ' A' ' 79' ' ' ILE . 51.7 m-80 -124.42 88.19 53.4 Favored Pre-proline 0 N--CA 1.473 0.714 0 O-C-N 122.2 -0.312 . . . . 61.04 110.838 174.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.409 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . 85.8 Cg_endo -82.32 128.52 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.946 2.431 . . . . 73.43 113.868 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.6 pt -137.58 123.83 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.166 0.508 . . . . 62.44 111.02 171.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 142.42 48.79 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 122.121 -0.362 . . . . 74.13 110.381 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 t70 . . . . . 0 CA--C 1.537 0.465 0 CA-C-O 121.317 0.58 . . . . 73.41 112.095 -175.982 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 . . . . . 0 N--CA 1.47 0.574 0 CA-C-O 121.101 0.477 . . . . 74.23 111.63 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -111.05 128.65 55.93 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.029 0.751 . . . . 61.22 113.029 -171.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 66.4 mt -120.57 128.36 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.279 -0.873 . . . . 72.11 110.527 177.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.35 131.4 42.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.905 0.383 . . . . 74.3 110.278 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.65 162.92 24.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.513 0.673 . . . . 72.53 112.605 -176.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 26.8 t70 -78.3 -40.55 36.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.19 -0.914 . . . . 62.41 111.425 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -169.44 155.89 6.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.003 0.43 . . . . 73.35 111.46 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.454 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 31.7 mt -120.92 118.68 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 115.892 -0.595 . . . . 74.45 110.722 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.9 m -122.75 168.93 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 120.934 0.397 . . . . 73.01 111.626 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.462 HD23 HG12 ' A' ' 76' ' ' VAL . 69.2 mt -74.73 133.57 42.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.809 0.338 . . . . 71.44 111.494 176.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.534 0.339 0 CA-C-N 116.475 -0.33 . . . . 71.22 110.381 176.255 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 96.8 mt . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.831 0.348 . . . . 73.53 111.306 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.518 ' N ' ' HE2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -102.62 112.93 25.9 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.483 -0.326 . . . . 75.12 111.075 176.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.453 ' HE1' ' CD1' ' A' ' 46' ' ' TYR . 86.0 t80 -78.82 113.25 16.74 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.254 -0.43 . . . . 73.25 111.742 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.6 p -101.19 -60.09 1.59 Allowed 'General case' 0 N--CA 1.474 0.741 0 O-C-N 122.109 -0.37 . . . . 70.22 111.919 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.16 173.95 15.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.91 0.707 . . . . 42.24 112.91 -178.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -92.65 116.65 29.2 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.525 -0.761 . . . . 73.42 110.984 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 19.3 tpt180 -71.51 -54.61 10.0 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.405 0.52 . . . . 72.24 112.405 -173.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -164.7 146.9 8.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.081 0.467 . . . . 75.25 111.922 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.4 mt-10 -114.03 99.39 7.61 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.018 -0.537 . . . . 64.21 110.501 175.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -71.91 120.57 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.358 0.599 . . . . 70.34 110.702 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.2 mtt180 -98.16 165.94 11.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.349 0.595 . . . . 64.04 112.301 -173.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.9 mt -69.34 112.51 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.659 -0.7 . . . . 72.14 111.319 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 58.3 tt0 -86.51 120.18 27.56 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.14 -0.482 . . . . 60.55 110.838 -178.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.05 173.7 5.25 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.132 0.79 . . . . 74.44 113.132 -174.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -53.98 -41.5 67.97 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.55 -0.75 . . . . 65.11 112.344 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.7 -26.93 68.88 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.068 0.461 . . . . 72.34 112.053 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.14 -15.97 30.34 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.07 -0.586 . . . . 25.14 111.788 -171.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 m -72.14 137.84 47.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.006 0.431 . . . . 40.14 110.9 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.6 t -82.08 144.31 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-N 116.372 -0.377 . . . . 73.25 111.876 -175.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.8 t -95.3 176.44 6.21 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.915 0.388 . . . . 54.33 111.794 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -80.11 -29.87 39.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.943 0.401 . . . . 73.54 111.252 177.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.03 138.97 58.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.277 -0.42 . . . . 71.11 111.031 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.3 mt -101.81 147.93 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 112.059 0.392 . . . . 52.42 112.059 -175.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -94.74 -57.31 2.5 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 116.535 -0.302 . . . . 63.12 110.87 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -152.26 165.7 34.07 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.986 0.422 . . . . 64.13 111.857 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.54 ' HD3' HD13 ' A' ' 67' ' ' LEU . 64.9 mtt180 -128.8 137.66 51.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.932 0.396 . . . . 73.43 112.049 -172.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.4 m -113.57 132.49 55.7 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.369 -0.378 . . . . 62.34 111.936 -177.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.514 ' OH ' HD12 ' A' ' 67' ' ' LEU . 51.5 m-85 -109.6 157.67 18.8 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 120.774 0.321 . . . . 74.31 111.751 178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.42 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 55.3 m-20 -92.45 106.77 18.7 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.295 -0.411 . . . . 74.41 110.233 169.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.455 HD12 HG21 ' A' ' 59' ' ' VAL . 58.9 mt -115.45 134.08 55.43 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.146 0.498 . . . . 71.53 111.846 -178.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -93.96 128.74 40.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.162 -0.472 . . . . 72.41 111.003 177.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 61.5 p . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 112.479 0.548 . . . . 53.22 112.479 -175.761 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 121.412 0.625 . . . . 71.43 111.938 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.8 OUTLIER -87.72 125.12 34.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.449 -0.796 . . . . 74.03 110.86 176.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 100' ' ' ILE . 27.0 pt -125.5 141.12 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.975 0.417 . . . . 75.03 111.823 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 22.1 mp0 -95.68 105.93 17.98 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.989 0.424 . . . . 62.22 111.325 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 100' ' ' ILE . 93.4 t -100.01 128.47 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.652 0.263 . . . . 72.41 111.218 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 22.6 t -118.33 138.96 52.04 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.325 0.491 . . . . 73.31 112.325 -174.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.429 HG21 HG13 ' A' ' 105' ' ' ILE . 44.7 pt -133.76 149.01 70.74 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.282 -0.417 . . . . 71.25 111.109 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.44 145.48 94.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.433 2.089 . . . . 72.01 113.125 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -6.07 19.53 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.975 0.417 . . . . 64.42 112.073 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 55.3 p -74.02 -20.83 60.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.183 0.516 . . . . 74.34 110.679 172.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.6 t -89.78 124.8 62.93 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 115.849 -0.614 . . . . 73.2 110.864 177.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -49.73 126.42 16.44 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.813 2.342 . . . . 75.54 113.448 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.612 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 29.4 tp -56.75 126.32 26.34 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.106 -0.497 . . . . 64.11 111.074 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -69.72 -63.07 1.15 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.923 0.712 . . . . 74.34 112.923 -170.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.612 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 36.7 mt-10 56.25 45.61 22.79 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.757 0.651 . . . . 62.2 112.757 176.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -75.6 -169.17 0.98 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.824 0.345 . . . . 73.04 111.854 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -74.94 164.73 26.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.627 0.603 . . . . 64.45 112.627 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -70.92 125.4 26.73 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.863 -0.608 . . . . 72.11 111.113 -178.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 59.16 31.54 21.35 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 122.854 0.462 . . . . 71.12 111.878 -175.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.65 150.8 30.84 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.517 -0.31 . . . . 75.54 111.518 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.463 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 99.3 mtt180 -68.49 106.19 2.47 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.299 0.481 . . . . 73.12 112.299 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 35.7 m -123.2 141.65 42.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.422 -0.354 . . . . 75.34 111.095 174.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -128.82 164.71 22.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.333 0.587 . . . . 75.33 111.391 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.454 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.5 mt -102.24 136.65 41.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.968 -0.56 . . . . 62.41 112.025 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.567 HG22 ' ND2' ' A' ' 80' ' ' ASN . 49.7 mm -70.96 -76.14 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.184 -0.462 . . . . 72.23 111.417 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.567 ' ND2' HG22 ' A' ' 79' ' ' ILE . 44.8 m-80 -121.25 85.39 41.88 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.171 -0.33 . . . . 61.42 110.525 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -82.46 149.07 14.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.113 2.542 . . . . 51.41 114.703 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.7 pt -128.58 139.69 51.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.171 0.51 . . . . 73.55 110.122 168.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.66 105.75 17.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.286 -0.416 . . . . 71.52 111.859 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 121.293 0.568 . . . . 74.32 112.023 -179.861 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 . . . . . 0 C--O 1.236 0.39 0 CA-C-O 121.172 0.51 . . . . 72.32 112.238 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.433 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 76.2 m-85 -105.16 154.22 20.48 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.749 -0.66 . . . . 70.34 112.253 -177.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 57' ' ' ILE . 66.7 mt -135.85 107.39 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.427 -0.806 . . . . 64.2 109.76 175.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.3 mtpp -86.13 120.88 27.99 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.363 0.601 . . . . 72.24 111.101 -177.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.09 144.33 43.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.098 0.475 . . . . 71.04 112.165 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -56.31 -44.38 79.84 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.895 -0.593 . . . . 73.15 111.133 173.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -165.34 158.09 15.82 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.162 -0.472 . . . . 75.33 110.95 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.485 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 23.8 mt -123.43 122.46 65.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.093 -0.503 . . . . 60.34 110.915 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.5 m -124.62 177.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.608 0.242 . . . . 62.32 111.261 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.4 mt -76.96 137.91 39.33 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 122.411 -0.181 . . . . 74.51 110.792 174.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 32.5 m . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 120.755 0.312 . . . . 42.21 111.296 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.3 mt . . . . . 0 N--CA 1.467 0.377 0 N-CA-C 110.291 -0.263 . . . . 72.21 110.291 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -127.84 133.47 49.38 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.146 0.498 . . . . 73.14 112.312 -178.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.494 ' HE1' ' HD2' ' A' ' 46' ' ' TYR . 65.7 t80 -77.84 114.75 17.0 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.719 -0.673 . . . . 74.45 111.555 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.7 m -97.39 -62.83 1.2 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.875 0.324 . . . . 64.33 111.875 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.21 171.08 20.85 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.465 0.543 . . . . 72.45 112.465 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -83.2 134.66 34.95 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.936 -0.574 . . . . 75.33 110.847 176.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -86.65 -58.74 2.49 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.646 0.26 . . . . 64.4 111.663 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 26' ' ' ARG . 31.4 ttm180 -172.65 137.14 0.78 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.115 0.413 . . . . 64.44 112.115 -178.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -94.83 109.06 21.08 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.316 -0.402 . . . . 73.31 110.066 172.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.0 m -77.81 120.74 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 121.12 0.486 . . . . 72.35 111.31 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.454 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 62.6 mtm180 -104.44 -178.46 3.66 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.403 0.621 . . . . 73.05 112.293 -174.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.507 HG12 ' HE2' ' A' ' 42' ' ' LYS . 52.8 mt -99.42 118.85 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.909 -0.587 . . . . 64.15 111.806 -175.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 53.9 tt0 -85.51 118.19 24.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.055 0.455 . . . . 64.04 110.825 175.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.9 m-20 -74.29 167.54 21.42 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.959 0.725 . . . . 71.34 112.959 -172.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.49 -11.38 60.64 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.849 -0.614 . . . . 70.32 111.065 176.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -68.69 -32.02 71.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.281 0.562 . . . . 72.02 110.788 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.09 -33.26 5.11 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 115.859 -0.609 . . . . 64.33 111.952 -174.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.8 p -81.28 158.88 24.63 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.087 0.47 . . . . 64.03 111.27 176.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 38.3 t -93.66 125.02 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 120.712 0.291 . . . . 72.0 111.78 -177.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.448 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 41.0 t -65.77 152.71 43.7 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.094 0.473 . . . . 73.21 111.407 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.454 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 6.0 m-20 -77.45 -1.87 32.47 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.154 0.502 . . . . 61.13 111.064 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.9 142.48 45.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.137 -0.483 . . . . 73.03 110.682 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.428 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 62.5 mt -108.27 143.47 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.066 0.46 . . . . 74.45 112.079 -173.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HE2' HG12 ' A' ' 30' ' ' ILE . 69.7 mmtt -88.29 -58.63 2.49 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.072 0.463 . . . . 71.04 110.616 171.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -145.06 171.47 14.44 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.013 -0.539 . . . . 72.44 111.078 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 44' ' ' ARG . 45.7 ttm105 -134.07 114.81 13.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.435 -0.348 . . . . 54.12 111.386 -176.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.1 m -97.47 128.41 44.22 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.491 0.552 . . . . 61.33 112.491 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.494 ' HD2' ' HE1' ' A' ' 21' ' ' PHE . 80.1 m-85 -110.68 158.05 19.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.24 0.616 . . . . 74.45 111.365 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -99.94 107.22 19.14 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.525 -0.307 . . . . 73.04 110.484 170.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.9 mt -109.63 121.78 45.98 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.79 0.329 . . . . 72.33 110.849 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -76.05 144.39 40.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.07 0.462 . . . . 71.33 111.376 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' ARG . 34.2 m . . . . . 0 N--CA 1.468 0.472 0 CA-C-N 116.075 -0.511 . . . . 72.51 111.222 -177.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 50' ' ' SER . 11.7 ptm180 . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 120.621 0.248 . . . . 65.44 110.46 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -95.67 -179.55 4.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.978 0.418 . . . . 75.53 111.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.539 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 30.7 pt -126.65 138.11 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 116.266 -0.424 . . . . 74.34 111.194 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -102.46 107.72 18.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.717 -0.614 . . . . 73.21 110.86 176.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.629 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 97.9 t -100.38 125.46 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.8 0.667 . . . . 63.21 112.8 -172.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -108.05 127.78 54.09 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.039 0.447 . . . . 61.44 111.315 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.415 HD12 ' HB ' ' A' ' 65' ' ' VAL . 37.0 pt -113.58 151.98 45.01 Favored Pre-proline 0 N--CA 1.473 0.675 0 CA-C-N 116.465 -0.334 . . . . 74.14 111.0 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.6 154.4 73.94 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.195 1.93 . . . . 72.42 112.766 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.58 -18.81 8.33 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.363 0.505 . . . . 75.41 112.363 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.2 m -60.89 -19.67 60.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.795 0.438 . . . . 72.22 111.998 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 24.2 t -114.48 120.02 38.77 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 116.666 -0.243 . . . . 62.35 110.893 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 16.7 Cg_exo -68.49 -172.43 0.45 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.033 2.489 . . . . 74.0 113.799 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.6 tp -72.1 147.41 46.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.049 -0.523 . . . . 75.5 111.092 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.475 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.9 mptp? -94.89 111.82 23.58 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.028 0.442 . . . . 54.22 111.388 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -80.74 65.03 5.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.205 0.526 . . . . 53.14 111.061 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -98.22 166.85 11.2 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.636 0.731 . . . . 70.31 112.304 -177.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.467 ' HB3' ' HB2' ' A' ' 74' ' ' ALA . 24.8 t70 -74.53 149.05 40.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.299 -0.864 . . . . 71.24 111.462 178.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.2 122.62 16.59 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.023 0.439 . . . . 65.15 111.642 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 64.07 30.23 13.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.1 0.56 . . . . 73.13 111.89 -177.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 71' ' ' ASP . . . -80.59 151.33 29.14 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.719 0.295 . . . . 31.33 111.352 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -66.96 125.1 24.89 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.639 -0.255 . . . . 73.35 111.473 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.61 152.33 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 121.14 0.495 . . . . 64.44 112.007 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -137.69 169.52 17.64 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.858 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -107.79 155.02 20.69 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.714 0.769 . . . . 72.34 113.053 -174.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.463 HG22 HD22 ' A' ' 80' ' ' ASN . 40.5 mm -111.2 116.28 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 115.156 -0.929 . . . . 61.51 109.522 173.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.463 HD22 HG22 ' A' ' 79' ' ' ILE . 53.1 m-80 53.84 75.46 0.62 Allowed Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 122.645 0.378 . . . . 74.0 111.917 -173.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.58 130.82 7.07 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.68 2.253 . . . . 55.54 114.104 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 101' ' ' LYS . 48.7 pt -132.68 161.01 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.355 -0.384 . . . . 73.42 110.909 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.85 140.52 37.01 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.806 -0.558 . . . . 54.31 111.303 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 . . . . . 0 CA--C 1.547 0.858 0 CA-C-O 120.952 0.406 . . . . 74.31 110.989 -177.835 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.539 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 122.538 1.161 . . . . 74.3 114.027 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -95.72 113.02 24.62 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.031 -1.441 . . . . 75.42 111.512 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 9.9 mt -96.11 165.46 2.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.544 -0.909 . . . . 73.51 108.544 172.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HB2' HG13 ' A' ' 82' ' ' ILE . 28.5 mtpt -140.27 163.84 31.69 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.567 -0.708 . . . . 70.13 110.762 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -154.34 156.01 36.13 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.054 0.454 . . . . 62.13 111.87 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -74.94 -21.96 58.87 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.061 -0.518 . . . . 73.52 110.29 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -171.24 160.88 6.41 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.168 0.509 . . . . 54.21 111.482 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.475 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 38.5 mt -127.34 123.59 62.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.154 -0.475 . . . . 65.24 110.814 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.3 m -128.75 -179.43 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 122.411 0.284 . . . . 73.4 111.125 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 98.0 mt -78.41 144.17 36.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.757 0.313 . . . . 71.41 111.142 176.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 120.924 0.392 . . . . 61.41 111.407 -179.301 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt . . . . . 0 CA--C 1.537 0.481 0 N-CA-C 110.303 -0.258 . . . . 75.21 110.303 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -123.23 114.73 20.65 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.844 -0.535 . . . . 74.33 111.607 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -63.75 132.12 49.99 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.258 0.466 . . . . 71.12 112.258 -176.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.9 t -109.15 -65.01 1.18 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.131 0.419 . . . . 73.33 112.131 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.49 173.68 15.21 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.117 0.484 . . . . 63.21 112.06 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.2 tp -88.37 117.28 27.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.318 -0.401 . . . . 74.25 110.411 173.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -72.69 -62.38 1.47 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.969 0.414 . . . . 74.13 112.026 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -170.1 143.7 2.52 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.058 -0.519 . . . . 64.11 111.562 -175.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.0 mt-10 -105.23 103.66 13.24 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.375 -0.602 . . . . 65.51 109.375 170.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.537 HG23 ' HB2' ' A' ' 42' ' ' LYS . 15.9 m -67.25 102.03 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.587 0.708 . . . . 71.1 110.876 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 98.9 mtt180 -98.52 158.31 15.68 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.719 0.637 . . . . 70.01 112.719 -171.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.5 mt -69.02 109.3 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.586 -0.733 . . . . 70.2 112.076 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.0 tt0 -86.85 124.52 33.17 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.904 0.383 . . . . 73.11 110.332 174.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -70.43 155.44 40.69 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.795 0.331 . . . . 73.41 111.728 -178.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -23.71 62.72 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.407 0.623 . . . . 74.31 110.666 169.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.1 -28.06 64.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.652 -0.704 . . . . 71.04 111.499 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.81 -36.6 4.02 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 116.26 -0.427 . . . . 50.32 112.456 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.3 p -71.33 150.64 44.92 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 50.2 111.817 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 22.8 t -92.37 145.92 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.158 -0.474 . . . . 65.32 111.078 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.2 t -101.7 163.4 12.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.111 0.482 . . . . 62.43 111.835 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -77.54 -18.1 57.3 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.986 -0.552 . . . . 64.23 111.141 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.72 132.1 45.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.279 -0.419 . . . . 73.04 110.086 173.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 26.2 mt -109.84 147.47 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 112.069 0.396 . . . . 52.11 112.069 -169.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HB2' HG23 ' A' ' 28' ' ' VAL . 39.7 mmtm -74.56 -61.06 2.0 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.416 -0.587 . . . . 61.14 109.416 169.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -155.26 167.23 31.05 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.384 -0.825 . . . . 63.35 110.022 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.462 ' HD3' ' OH ' ' A' ' 46' ' ' TYR . 4.3 ptp85 -122.7 133.72 54.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.161 0.505 . . . . 73.32 112.157 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.5 m -107.52 124.93 50.63 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.858 -0.61 . . . . 74.15 112.474 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' OH ' ' HD3' ' A' ' 44' ' ' ARG . 79.7 m-85 -110.81 153.66 25.05 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 122.88 0.472 . . . . 74.24 111.143 176.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.64 114.33 26.25 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.06 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.543 HD12 HG21 ' A' ' 59' ' ' VAL . 47.4 mt -114.21 132.34 56.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.569 0.7 . . . . 73.5 111.77 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 2.6 mmmp? -93.28 150.99 20.07 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.557 -0.747 . . . . 73.2 111.16 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.2 m . . . . . 0 N--CA 1.472 0.647 0 CA-C-O 120.871 0.367 . . . . 70.04 111.802 179.772 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.452 HH11 ' HD3' ' A' ' 55' ' ' ARG . 36.9 mtt180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 121.086 0.469 . . . . 75.22 111.119 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.9 ttt -128.43 148.63 50.72 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.975 -0.557 . . . . 65.11 110.763 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 pt -135.48 135.44 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.918 0.389 . . . . 73.35 111.28 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -98.11 105.73 17.92 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.109 0.48 . . . . 52.41 110.494 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.543 HG21 HD12 ' A' ' 48' ' ' LEU . 70.1 t -94.41 129.98 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.343 -0.389 . . . . 73.33 111.715 -174.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.5 ' O ' ' HA ' ' A' ' 101' ' ' LYS . 39.9 m -118.38 141.82 48.15 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.944 0.402 . . . . 73.55 111.292 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.1 pt -131.24 150.97 78.0 Favored Pre-proline 0 CA--C 1.539 0.525 0 O-C-N 122.305 -0.247 . . . . 72.3 110.928 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HG2' HG23 ' A' ' 65' ' ' VAL . 12.2 Cg_endo -55.76 146.13 68.09 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.481 2.12 . . . . 73.2 112.974 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.49 -28.49 59.94 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.678 0.621 . . . . 43.25 112.678 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.0 m -62.23 -26.5 68.41 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.079 0.4 . . . . 63.41 112.079 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.471 HG23 ' HG2' ' A' ' 62' ' ' PRO . 51.0 t -79.01 125.05 84.48 Favored Pre-proline 0 CA--C 1.544 0.723 0 CA-C-N 116.841 -0.163 . . . . 52.0 110.996 179.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -64.73 161.35 36.3 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.408 . . . . 73.2 114.416 -174.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.7 tp -67.61 138.16 56.19 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.835 -0.621 . . . . 73.04 111.224 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.4 mptp? -81.84 -48.98 10.89 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.266 0.839 . . . . 74.42 113.266 -173.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 63.77 21.59 12.73 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.834 0.679 . . . . 73.13 112.834 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -64.66 159.5 21.9 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.009 0.433 . . . . 61.22 111.865 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 4.9 m-20 -68.06 154.22 42.1 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.409 0.623 . . . . 72.11 112.512 -177.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -65.02 133.53 51.88 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.718 -0.673 . . . . 73.04 111.178 174.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 63.3 19.54 11.74 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.189 0.596 . . . . 73.1 112.481 -177.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -82.22 153.65 25.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.156 0.428 . . . . 50.21 112.156 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.529 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 65.4 mtt85 -70.77 104.35 2.86 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.954 -0.566 . . . . 33.21 112.111 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.443 HG12 HD23 ' A' ' 107' ' ' LEU . 31.8 m -120.13 153.06 23.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.099 -0.5 . . . . 75.13 111.273 177.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -145.92 173.49 12.1 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.131 0.491 . . . . 73.44 111.064 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HG11 ' A' ' 59' ' ' VAL . 81.8 mt -112.18 132.17 55.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.061 0.457 . . . . 52.33 111.981 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.599 HG22 ' ND2' ' A' ' 80' ' ' ASN . 48.5 mm -65.04 -59.54 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 115.916 -0.584 . . . . 64.23 111.337 178.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.599 ' ND2' HG22 ' A' ' 79' ' ' ILE . 47.5 m-80 -130.41 87.41 50.53 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 122.388 -0.195 . . . . 75.42 110.936 174.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.34 140.4 10.87 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.219 2.612 . . . . 64.22 114.509 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.8 pt -136.11 149.57 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 120.828 0.347 . . . . 54.13 110.858 172.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.35 117.36 29.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.579 0.228 . . . . 64.54 111.097 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 113.527 0.936 . . . . 72.53 113.527 -173.262 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 113.537 0.94 . . . . 73.21 113.537 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.03 148.41 41.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.954 -1.021 . . . . 71.44 111.64 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 65.1 mt -129.01 115.04 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.106 -0.497 . . . . 52.32 110.24 177.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 60' ' ' SER . 45.7 mtpt -89.98 136.14 33.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 64.31 111.813 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.13 153.29 43.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.339 0.59 . . . . 71.43 112.068 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.6 t70 -63.94 -40.66 96.95 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.309 0.576 . . . . 72.14 111.028 173.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -165.22 158.49 16.5 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.742 -0.663 . . . . 72.53 111.112 179.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.445 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 39.2 mt -119.01 123.23 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.136 -0.484 . . . . 53.14 111.25 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 36.0 m -128.12 -179.8 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 120.781 0.324 . . . . 64.13 111.75 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.443 HD23 HG12 ' A' ' 76' ' ' VAL . 87.5 mt -91.58 138.16 31.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 73.41 111.435 177.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.529 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 8.3 m . . . . . 0 N--CA 1.47 0.567 0 CA-C-N 116.046 -0.525 . . . . 53.24 111.452 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 tpt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 121.049 0.452 . . . . 75.14 111.641 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -167.81 139.06 2.92 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.913 -0.585 . . . . 74.14 109.737 174.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -90.65 122.5 33.49 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.381 0.61 . . . . 74.31 111.776 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -98.62 133.22 43.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.719 -0.673 . . . . 73.2 111.014 177.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.26 119.57 7.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.29 -0.414 . . . . 71.02 111.688 178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -85.19 -2.85 58.49 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.933 0.397 . . . . 71.22 111.807 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.44 -146.59 4.37 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 121.27 -0.491 . . . . 73.25 112.992 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 pt -108.35 146.45 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 121.01 0.433 . . . . 75.21 111.688 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.6 t -72.52 -54.34 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.149 0.499 . . . . 54.45 110.807 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.06 168.08 18.0 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.131 -0.486 . . . . 70.22 110.776 176.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -106.99 148.5 28.6 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.618 0.246 . . . . 74.44 110.924 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.503 ' HE2' ' OG1' ' A' ' 14' ' ' THR . 23.4 pttm -125.13 145.07 50.11 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.851 0.358 . . . . 74.02 111.218 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -89.11 13.94 11.94 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.224 0.453 . . . . 64.41 112.224 -176.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.503 ' OG1' ' HE2' ' A' ' 12' ' ' LYS . 58.0 p -63.61 -23.23 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.049 0.452 . . . . 72.25 111.529 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -68.47 -5.49 19.65 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.12 -0.491 . . . . 74.44 111.987 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.4 t80 72.12 -64.95 0.37 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.745 0.783 . . . . 71.35 110.375 177.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -166.65 -112.18 0.26 Allowed Glycine 0 CA--C 1.519 0.341 0 N-CA-C 109.511 -1.436 . . . . 73.4 109.511 173.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -103.86 106.51 17.04 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.352 -0.61 . . . . 73.42 109.352 161.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 93.4 mt -95.48 108.75 21.0 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.598 -0.519 . . . . 72.33 109.598 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.567 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 59.1 mtmt -124.26 134.8 53.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.255 0.55 . . . . 73.43 111.689 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.79 144.36 57.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.404 -0.816 . . . . 73.53 113.012 -173.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 71.7 m -123.55 -62.43 1.31 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.132 -0.485 . . . . 74.33 111.33 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.16 179.68 8.8 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.161 0.505 . . . . 50.24 111.916 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.2 tp -101.94 101.32 11.72 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.485 -0.561 . . . . 63.32 109.485 170.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HG2' ' OE1' ' A' ' 58' ' ' GLN . 10.4 tpp180 -58.3 -58.82 6.8 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.225 0.454 . . . . 71.12 112.225 -173.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.1 ttt180 -169.14 135.21 1.67 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.84 0.353 . . . . 74.11 111.73 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -98.82 98.14 9.27 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 110.006 -0.368 . . . . 70.42 110.006 174.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.8 m -69.49 135.84 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.805 0.336 . . . . 51.31 110.75 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.464 ' HG2' HD13 ' A' ' 41' ' ' ILE . 80.7 mtt180 -116.68 170.25 8.73 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.476 0.655 . . . . 74.23 112.742 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -75.1 113.65 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 115.577 -0.738 . . . . 73.14 111.385 -175.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -83.56 133.83 34.85 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.934 0.397 . . . . 63.4 111.932 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -80.6 150.25 29.58 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.544 -0.298 . . . . 61.43 110.858 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.22 -34.67 70.66 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.866 0.365 . . . . 65.51 111.97 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.53 -27.62 66.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.302 -0.408 . . . . 74.11 111.975 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 138.26 -57.52 0.64 Allowed Glycine 0 CA--C 1.524 0.64 0 C-N-CA 120.827 -0.701 . . . . 53.01 113.042 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.1 m -62.96 149.79 43.87 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.428 0.633 . . . . 72.14 112.375 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 39.5 t -90.94 147.55 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.979 -0.555 . . . . 72.32 111.228 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -81.31 174.54 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.574 0.702 . . . . 72.25 112.123 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -88.23 -10.4 49.87 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.535 -0.757 . . . . 72.13 111.225 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 29' ' ' ARG . 21.9 mm-40 -81.89 144.04 31.25 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.125 0.488 . . . . 71.23 111.871 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.464 HD13 ' HG2' ' A' ' 29' ' ' ARG . 20.7 mm -85.08 153.43 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.945 -0.571 . . . . 53.25 112.323 -172.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -113.9 -58.17 2.18 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 116.343 -0.39 . . . . 72.54 110.107 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -141.13 160.46 40.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.051 0.54 . . . . 72.45 110.825 172.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 44' ' ' ARG . 37.7 mtt180 -119.05 117.46 28.82 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.595 0.236 . . . . 75.45 110.899 178.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.0 m -96.2 121.35 37.89 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 111.91 0.337 . . . . 54.35 111.91 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.407 ' OH ' HD12 ' A' ' 67' ' ' LEU . 55.8 m-85 -108.47 153.92 22.64 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.235 0.541 . . . . 72.32 112.021 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -97.0 112.58 24.27 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.757 -0.656 . . . . 74.55 110.716 174.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.654 HD12 HG21 ' A' ' 59' ' ' VAL . 81.4 mt -123.66 137.42 54.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.691 0.282 . . . . 71.53 111.19 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.52 140.46 32.73 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.763 0.316 . . . . 72.24 110.418 174.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.7 p -130.94 149.42 52.57 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.131 0.491 . . . . 73.12 111.486 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -79.83 121.65 25.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.324 -0.398 . . . . 72.11 111.43 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.28 -98.3 0.15 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 121.086 -0.578 . . . . 52.4 113.068 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -92.67 -1.39 56.9 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.048 0.388 . . . . 54.42 112.048 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 77.37 34.99 38.72 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 121.206 -0.521 . . . . 50.42 113.567 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -110.88 129.11 55.96 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.296 0.48 . . . . 73.5 112.296 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.4 ptp -72.92 118.69 16.17 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.234 -0.439 . . . . 72.51 109.983 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.9 pt -94.74 138.08 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-O 120.996 0.426 . . . . 71.41 111.947 -173.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.495 ' OE1' ' HG2' ' A' ' 25' ' ' ARG . 25.2 mm-40 -93.16 104.71 16.88 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.24 -0.436 . . . . 75.55 110.977 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.654 HG21 HD12 ' A' ' 48' ' ' LEU . 81.0 t -98.49 116.16 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 CA-C-O 120.875 0.369 . . . . 73.23 111.481 -177.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.9 t -111.06 123.93 51.16 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.872 0.368 . . . . 43.11 111.697 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.401 HD12 ' CG1' ' A' ' 65' ' ' VAL . 32.0 pt -115.31 147.06 37.79 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.328 -0.396 . . . . 70.05 110.944 176.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.95 157.61 51.83 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 122.325 2.017 . . . . 70.05 113.698 -177.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.01 -33.27 66.99 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.879 0.696 . . . . 61.24 112.879 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 58.4 m -58.32 -19.42 34.83 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.737 0.303 . . . . 45.23 111.721 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG1' HD12 ' A' ' 61' ' ' ILE . 43.9 t -91.31 126.07 56.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-N 116.545 -0.298 . . . . 73.21 110.829 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.78 162.1 43.38 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.406 2.07 . . . . 71.42 113.149 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.407 HD12 ' OH ' ' A' ' 46' ' ' TYR . 52.6 tp -72.42 142.33 48.67 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 116.202 -0.454 . . . . 75.53 111.183 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.02 106.72 15.89 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.259 0.552 . . . . 74.33 111.475 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -74.79 74.87 2.1 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.72 -0.673 . . . . 74.11 111.568 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -94.67 154.43 17.33 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.967 0.413 . . . . 65.54 112.009 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.3 170.47 16.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.005 0.431 . . . . 63.45 111.671 178.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -67.75 129.95 41.48 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.043 0.449 . . . . 62.34 111.687 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.567 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 90.3 m-20 69.42 18.31 7.91 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.604 0.762 . . . . 64.11 113.028 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.38 132.66 52.2 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.193 -0.317 . . . . 73.12 110.958 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.1 mtm180 -76.36 118.67 19.3 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.025 0.44 . . . . 65.32 111.932 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.563 HG12 HD23 ' A' ' 107' ' ' LEU . 34.0 m -124.75 161.38 28.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.999 -0.546 . . . . 71.52 111.489 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -138.49 147.23 42.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.125 0.488 . . . . 72.21 110.311 171.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.9 mt -97.81 137.49 36.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.308 -0.405 . . . . 60.04 112.035 -173.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.5 mm -63.57 -71.16 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 CA-C-N 116.12 -0.491 . . . . 75.21 111.413 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.477 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 92.4 m-20 -122.75 82.96 48.95 Favored Pre-proline 0 N--CA 1.473 0.694 0 CA-C-O 120.667 0.27 . . . . 64.23 111.438 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -82.43 132.2 6.81 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.977 2.451 . . . . 73.44 113.574 176.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.5 pt -136.91 125.71 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 120.858 0.361 . . . . 73.13 111.492 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.02 114.11 18.68 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.302 -0.259 . . . . 41.21 110.302 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -90.79 173.09 8.19 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.604 0.716 . . . . 60.1 112.495 -170.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 85' ' ' THR . 20.2 m -129.99 13.41 5.74 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.528 -0.76 . . . . 64.03 109.946 171.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -83.37 -32.37 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 116.283 -0.417 . . . . 74.14 111.534 -177.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.56 -56.87 9.96 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.04 0.448 . . . . 71.51 110.73 175.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p -65.53 -7.2 13.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.011 -0.54 . . . . 74.11 112.194 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -85.16 -24.46 27.94 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.825 0.306 . . . . 62.31 111.825 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.8 t -108.98 -21.62 12.55 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 111.891 0.33 . . . . 75.1 111.891 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -101.71 158.47 16.08 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.884 0.374 . . . . 61.41 111.072 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -154.44 120.79 5.38 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.033 0.444 . . . . 75.44 111.175 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 94.49 -30.52 7.7 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 121.134 -0.555 . . . . 50.03 112.923 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.69 -22.51 34.52 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.91 0.386 . . . . 73.33 111.651 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.7 82.19 1.57 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.46 . . . . 71.32 111.543 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -84.99 -28.47 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.326 -0.397 . . . . 74.1 111.557 177.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -126.3 167.26 15.73 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.69 0.281 . . . . 61.44 110.689 176.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -95.22 150.84 19.79 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.253 0.549 . . . . 63.52 112.329 -174.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -107.48 137.85 44.77 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.622 0.725 . . . . 65.03 112.318 -171.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 52.7 mt -126.68 109.16 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-N 115.567 -0.742 . . . . 71.54 110.716 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -82.73 129.2 34.93 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 122.138 -0.351 . . . . 73.54 110.493 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.9 167.39 13.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.289 0.566 . . . . 61.52 112.355 -174.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.477 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 31.3 t70 -86.68 -62.04 1.6 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.763 -0.653 . . . . 64.42 111.235 177.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -145.59 155.03 42.79 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.127 0.489 . . . . 71.02 111.122 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 71.0 mt -111.81 115.07 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 115.734 -0.666 . . . . 60.42 111.577 -178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -123.32 172.23 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 120.549 0.214 . . . . 65.25 111.055 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.563 HD23 HG12 ' A' ' 76' ' ' VAL . 96.2 mt -83.15 150.0 26.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 122.284 -0.26 . . . . 74.32 110.892 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.1 m -62.63 105.86 0.7 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.762 0.315 . . . . 75.4 111.345 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.496 ' H ' HD23 ' A' ' 109' ' ' LEU . 0.5 OUTLIER -86.3 -11.93 50.85 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.533 0.568 . . . . 73.44 112.533 -174.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.403 ' OE1' ' HG2' ' A' ' 12' ' ' LYS . 51.2 mt-10 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.743 -0.646 . . . . 70.23 112.048 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 120.845 0.355 . . . . 72.21 111.57 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 64.9 mtt -132.91 153.01 51.79 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.581 0.353 . . . . 75.52 110.764 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.462 ' N ' ' HD2' ' A' ' 3' ' ' ARG . 7.8 mpt_? -96.84 125.11 41.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.855 0.359 . . . . 72.43 111.184 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.429 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.1 mm? -95.1 139.39 31.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.064 0.459 . . . . 75.45 110.911 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.27 165.69 19.16 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.272 0.558 . . . . 72.24 112.148 -177.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -72.66 153.33 41.26 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.843 -0.617 . . . . 73.12 111.452 -178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.73 89.88 0.12 Allowed Glycine 0 CA--C 1.526 0.771 0 C-N-CA 121.3 -0.476 . . . . 51.42 112.718 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 34.1 pt -91.65 176.16 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 112.59 0.589 . . . . 60.25 112.59 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 45.2 t -80.84 143.26 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 61.11 111.497 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 pp -140.29 170.1 16.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.422 -0.354 . . . . 61.51 111.374 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.35 107.23 0.87 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 61.11 111.852 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -115.7 122.75 46.46 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.282 -0.417 . . . . 61.12 111.008 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.9 t70 62.59 83.93 0.15 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.356 0.598 . . . . 71.31 110.867 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.8 p -94.41 -83.69 0.34 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.639 0.607 . . . . 73.1 112.639 -175.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 15' ' ' THR . 6.4 m -86.7 16.85 4.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.073 0.463 . . . . 71.54 111.524 -177.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 63.11 -179.5 0.15 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.381 0.61 . . . . 53.33 112.218 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -98.32 -145.14 18.27 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.207 -0.521 . . . . 43.41 112.059 174.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.58 124.88 37.87 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.732 0.777 . . . . 71.31 110.855 175.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.432 HD13 HD11 ' A' ' 57' ' ' ILE . 55.4 mt -89.15 159.22 17.6 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.466 -0.788 . . . . 64.5 111.965 -171.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.578 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 11.1 mptt -116.62 115.67 26.14 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.855 0.36 . . . . 71.3 111.506 178.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.402 ' HA ' HD23 ' A' ' 48' ' ' LEU . 91.1 t80 -66.8 126.77 30.08 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.231 -0.44 . . . . 72.44 111.154 177.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.559 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 82.0 p -106.83 -63.51 1.27 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.949 0.351 . . . . 72.4 111.949 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.92 176.61 12.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.345 0.593 . . . . 52.1 112.087 -177.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.44 HD21 ' HG3' ' A' ' 27' ' ' GLU . 61.1 tp -83.16 117.81 23.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.985 -0.552 . . . . 65.31 111.101 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -69.07 -66.81 0.53 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.939 0.399 . . . . 75.44 111.363 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.4 ttm180 -168.25 131.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.061 0.458 . . . . 73.12 111.745 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' HG3' HD21 ' A' ' 24' ' ' LEU . 47.2 mt-10 -96.8 99.37 10.95 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.315 -0.402 . . . . 64.53 110.058 173.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m -74.34 118.98 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.281 0.562 . . . . 73.25 111.516 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.638 ' HG2' HG12 ' A' ' 41' ' ' ILE . 96.3 mtt180 -96.54 164.36 12.64 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.443 0.64 . . . . 71.5 112.291 -177.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -76.88 111.19 13.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 115.793 -0.64 . . . . 71.53 111.041 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.5 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 61.6 tt0 -82.75 147.11 28.62 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.053 0.454 . . . . 75.13 111.617 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -90.93 166.94 12.78 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.924 0.392 . . . . 64.23 110.477 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -75.39 -24.73 57.25 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 122.131 -0.356 . . . . 74.53 111.678 -178.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -80.91 32.27 0.32 Allowed 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 111.965 0.357 . . . . 71.24 111.965 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.45 -48.08 3.75 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 114.182 0.433 . . . . 71.21 114.182 174.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 m -66.79 145.3 55.65 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.236 0.541 . . . . 72.15 112.428 -177.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.5 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.5 t -96.29 140.65 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.018 -0.537 . . . . 75.32 111.161 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 t -75.65 171.68 13.9 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.313 0.578 . . . . 71.34 111.293 178.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.3 -18.3 32.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 53.14 110.707 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.38 137.62 57.01 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.624 -0.716 . . . . 55.12 110.603 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.638 HG12 ' HG2' ' A' ' 29' ' ' ARG . 32.4 mt -104.46 142.57 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 121.179 0.514 . . . . 75.44 111.377 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.55 -57.78 2.38 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.274 -0.421 . . . . 72.33 111.043 179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' OG ' ' A' ' 60' ' ' SER . 61.7 mt-10 -137.46 148.48 46.13 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 120.992 0.425 . . . . 73.22 111.688 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -110.2 111.58 23.0 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.357 -0.383 . . . . 73.14 111.166 176.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.4 m -101.46 124.16 46.69 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.393 0.516 . . . . 72.15 112.393 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.447 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.2 m-85 -115.83 160.58 19.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.905 0.482 . . . . 72.31 111.045 177.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -101.12 125.61 47.75 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.714 0.292 . . . . 43.4 111.67 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.57 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -123.52 134.37 53.88 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-O 120.795 0.331 . . . . 71.11 111.722 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.559 ' HE2' ' HB3' ' A' ' 22' ' ' SER . 3.8 mptp? -80.77 147.25 30.59 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.98 0.419 . . . . 74.23 111.313 173.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -83.1 166.79 18.42 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.083 -0.508 . . . . 72.42 110.507 174.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.72 0.55 6.81 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 112.369 0.507 . . . . 74.55 112.369 178.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 142.5 27.48 0.16 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 121.013 -0.613 . . . . 61.03 113.917 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -91.35 -0.75 57.7 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.048 0.424 . . . . 70.02 111.832 -178.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.2 35.85 90.99 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.35 -0.452 . . . . 72.14 113.563 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 55' ' ' ARG . 5.3 ptp180 -140.82 137.07 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.975 0.417 . . . . 72.51 111.933 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 43.1 ttm -96.88 110.43 22.94 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.133 -0.485 . . . . 74.11 109.701 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.432 HD11 HD13 ' A' ' 19' ' ' LEU . 26.8 pt -95.1 127.97 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 121.026 0.441 . . . . 73.14 111.176 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.448 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 77.3 mt-30 -93.65 105.82 17.83 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.378 0.608 . . . . 71.03 110.656 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.57 HG21 HD12 ' A' ' 48' ' ' LEU . 84.0 t -94.82 122.53 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 115.988 -0.551 . . . . 74.55 111.986 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.729 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 24.5 t -114.35 130.21 56.67 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.968 0.413 . . . . 75.34 111.377 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.5 pt -120.36 156.2 55.54 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 116.315 -0.402 . . . . 71.55 110.982 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.35 125.75 19.44 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.452 2.101 . . . . 61.31 112.392 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.5 39.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.016 0.747 . . . . 73.41 113.016 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.0 t -56.82 -30.76 64.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.058 0.456 . . . . 54.13 111.519 175.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.4 t -78.75 133.88 61.75 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 116.069 -0.514 . . . . 72.24 111.328 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.49 158.01 4.41 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.379 2.719 . . . . 75.52 114.476 -178.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.447 HD12 ' OH ' ' A' ' 46' ' ' TYR . 58.6 tp -68.14 145.81 54.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.254 -0.885 . . . . 61.55 111.767 -178.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -90.12 126.03 35.65 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.254 0.549 . . . . 63.42 111.88 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -107.65 25.78 11.09 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.661 -0.7 . . . . 73.22 111.592 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -62.19 153.45 30.3 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.208 0.528 . . . . 75.21 112.087 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -80.97 164.71 22.35 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.894 -0.594 . . . . 33.12 112.267 -175.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -59.12 118.08 5.46 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.065 -0.516 . . . . 71.45 111.614 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.526 HD22 ' N ' ' A' ' 73' ' ' ASN . 0.8 OUTLIER 68.31 24.25 7.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.55 0.74 . . . . 73.42 112.216 -178.639 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.79 133.92 50.06 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.765 0.317 . . . . 73.53 111.3 176.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.578 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 75.5 mtm180 -74.63 113.49 11.95 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.116 0.484 . . . . 73.33 111.682 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.16 153.99 35.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.284 0.564 . . . . 73.31 111.999 -177.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.414 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.4 pt-20 -128.01 154.72 45.31 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.126 -0.488 . . . . 72.13 110.268 173.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.35 146.67 24.54 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.168 0.803 . . . . 71.41 113.168 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.72 112.49 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 115.336 -0.847 . . . . 62.4 110.036 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 58.78 62.01 4.59 Favored Pre-proline 0 CA--C 1.547 0.864 0 N-CA-C 112.023 0.379 . . . . 62.14 112.023 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -81.66 140.45 11.75 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.817 2.345 . . . . 75.1 113.8 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.44 147.23 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-O 120.945 0.402 . . . . 55.55 111.099 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.35 108.16 16.35 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.916 0.389 . . . . 72.03 110.693 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -80.76 98.11 7.62 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.214 0.53 . . . . 61.25 111.564 -174.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.8 p -73.46 -28.09 61.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.017 -0.538 . . . . 75.51 112.146 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 32.5 m -73.86 -15.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 N-CA-C 112.265 0.469 . . . . 63.23 112.265 -177.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.45 -59.34 4.7 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.739 0.274 . . . . 61.01 111.739 176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 t -62.57 -28.06 69.61 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 120.98 0.419 . . . . 65.53 111.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.27 60.31 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.845 0.355 . . . . 73.14 111.519 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 52.4 m -96.25 -41.09 8.84 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.847 0.356 . . . . 54.23 111.927 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -118.18 93.82 4.27 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.635 -0.257 . . . . 53.42 111.59 -176.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -77.46 143.49 38.5 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.003 0.43 . . . . 75.3 110.991 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 105.62 7.75 36.18 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 121.122 -0.561 . . . . 63.21 112.648 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -150.79 32.79 0.61 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.689 0.757 . . . . 51.2 109.566 176.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -75.68 -45.68 35.59 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.797 -1.092 . . . . 73.22 112.998 -168.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.5 p -71.08 -32.56 48.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 N-CA-C 112.798 0.666 . . . . 63.34 112.798 -172.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -88.4 80.97 7.32 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.544 0.688 . . . . 75.14 110.322 175.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 148.33 16.51 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 114.352 1.241 . . . . 74.13 114.352 -174.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.448 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -104.39 120.75 41.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 114.406 -1.27 . . . . 75.13 111.818 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.489 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 56.4 mt -99.59 107.18 20.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.219 -0.446 . . . . 74.31 109.968 175.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.729 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 58.7 mtpt -94.06 129.14 40.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.15 0.5 . . . . 73.33 111.942 -175.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.48 174.7 7.62 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.991 0.425 . . . . 71.42 111.467 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.23 -37.05 26.56 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.952 0.406 . . . . 71.2 110.787 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -161.01 164.93 30.6 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 116.316 -0.402 . . . . 73.32 111.502 177.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 44.2 mt -122.56 118.39 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 116.494 -0.321 . . . . 73.35 110.815 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.38 167.13 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 120.793 0.33 . . . . 74.11 111.652 -177.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -70.74 144.13 51.03 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.649 0.262 . . . . 71.23 111.123 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.414 ' HA ' ' HG2' ' A' ' 77' ' ' GLU . 57.8 m -63.54 121.6 14.26 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.837 0.351 . . . . 64.01 111.881 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 78.0 mt -66.01 94.26 0.23 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.164 -0.471 . . . . 74.54 111.635 178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 118.942 -0.551 . . . . 74.4 111.18 177.367 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.571 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 111.787 0.292 . . . . 61.4 111.787 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.5 ' HG2' ' HG2' ' A' ' 1' ' ' MET . 25.2 ptt? -176.54 133.49 0.22 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.812 0.339 . . . . 63.35 110.855 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.0 mtp180 -103.9 139.49 38.99 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.902 0.382 . . . . 63.2 111.57 -177.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.439 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.0 mm? -101.3 176.79 5.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.851 0.357 . . . . 64.1 110.795 176.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.27 -21.55 62.95 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.999 0.428 . . . . 75.23 111.965 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -69.83 112.67 6.43 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.451 -0.341 . . . . 71.13 111.903 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -112.74 -76.77 0.79 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 121.365 -0.445 . . . . 33.23 112.57 175.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.6 pt -105.97 158.53 6.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 72.24 111.742 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.5 t -130.76 118.78 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.366 -0.379 . . . . 65.33 110.565 177.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -65.15 166.9 8.88 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.065 0.459 . . . . 63.54 111.713 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -100.78 -60.27 1.55 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.465 -0.334 . . . . 71.42 111.732 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -174.45 102.41 0.1 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.951 0.405 . . . . 74.21 110.692 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -74.4 -18.13 60.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.563 0.579 . . . . 74.44 112.563 -176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.1 p -71.14 95.36 1.23 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.334 0.588 . . . . 75.31 111.367 179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.0 p -59.84 -14.08 13.47 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.752 0.649 . . . . 71.54 112.752 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.46 ' HA ' HE22 ' A' ' 53' ' ' GLN . 64.8 m-85 -85.9 -0.29 55.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.657 0.265 . . . . 74.35 111.523 177.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.42 -143.92 29.97 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 121.215 -0.517 . . . . 54.44 111.81 -172.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.459 ' H ' ' HB3' ' A' ' 51' ' ' LYS . 1.7 mp0 -87.76 131.22 34.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 117.306 0.553 . . . . 62.33 110.57 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -85.33 127.45 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.813 0.34 . . . . 75.31 110.174 175.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 56.9 mtmt -123.71 117.22 24.45 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.258 0.551 . . . . 72.3 111.978 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -58.7 157.46 9.35 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.948 -1.024 . . . . 73.11 113.03 -174.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.48 ' OG ' ' HE3' ' A' ' 49' ' ' LYS . 33.9 m -134.14 -65.22 0.66 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.208 0.448 . . . . 63.22 112.208 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.52 -179.29 7.53 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.222 0.534 . . . . 42.11 112.307 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.437 HD21 ' HG3' ' A' ' 27' ' ' GLU . 59.0 tp -88.29 120.08 29.32 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.833 -0.621 . . . . 40.5 110.308 176.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -76.37 -55.31 5.66 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.982 0.42 . . . . 74.42 111.421 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -173.57 131.74 0.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.141 -0.482 . . . . 75.42 111.003 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG3' HD21 ' A' ' 24' ' ' LEU . 37.7 mt-10 -90.83 98.63 11.89 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.721 -0.474 . . . . 60.42 109.721 171.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 28.4 m -67.27 119.22 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.33 0.586 . . . . 74.44 111.284 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.519 ' HG2' HG12 ' A' ' 41' ' ' ILE . 56.5 mtt180 -98.48 167.91 10.52 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.378 0.609 . . . . 63.41 112.081 -175.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.6 mt -83.07 100.22 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.842 -0.617 . . . . 74.24 112.041 -172.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 60.9 tt0 -79.41 120.74 24.26 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.482 -0.326 . . . . 75.34 110.961 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -67.46 153.34 43.91 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.379 0.511 . . . . 75.21 112.379 -174.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.02 -32.37 67.89 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.565 0.697 . . . . 61.14 110.702 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.24 -27.77 66.08 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.225 -0.898 . . . . 62.11 112.002 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.55 -42.15 1.52 Allowed Glycine 0 CA--C 1.526 0.78 0 C-N-CA 121.383 -0.437 . . . . 73.44 112.737 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.5 m -75.85 151.62 37.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.063 0.459 . . . . 74.14 111.702 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 36.9 t -88.13 136.86 22.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.411 -0.359 . . . . 72.11 111.414 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.8 t -84.83 149.89 25.4 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.765 0.317 . . . . 63.43 110.539 174.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -73.05 -14.79 61.48 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.131 0.419 . . . . 33.53 112.131 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.28 142.2 58.5 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.936 0.398 . . . . 64.14 111.333 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.519 HG12 ' HG2' ' A' ' 29' ' ' ARG . 43.9 mt -100.58 139.07 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.501 -0.318 . . . . 75.11 110.696 -178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -94.61 -58.29 2.23 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.776 0.322 . . . . 74.13 111.121 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.42 159.38 42.29 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.135 0.493 . . . . 73.11 111.505 177.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 37.2 mtt-85 -115.62 116.89 28.89 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.264 -0.425 . . . . 62.52 110.67 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 m -92.49 129.09 38.52 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.655 0.243 . . . . 44.33 111.655 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' OH ' HD12 ' A' ' 67' ' ' LEU . 49.6 m-85 -116.77 156.52 27.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.679 0.392 . . . . 72.42 111.442 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -100.18 112.78 25.1 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.166 -0.47 . . . . 75.33 111.061 176.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.429 HD12 HG21 ' A' ' 59' ' ' VAL . 42.2 mt -114.93 149.01 37.93 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 122.292 -0.255 . . . . 74.54 110.788 177.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.543 ' NZ ' ' HB2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -103.83 141.55 35.93 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 122.043 -0.411 . . . . 73.42 111.469 173.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.9 p -93.46 115.96 28.49 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.073 -0.512 . . . . 72.23 110.743 176.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.459 ' HB3' ' H ' ' A' ' 18' ' ' GLU . 1.2 tmtp? -57.92 -40.66 80.94 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.921 0.391 . . . . 63.43 111.507 178.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.36 -58.53 9.28 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.268 -0.492 . . . . 62.32 113.969 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.46 HE22 ' HA ' ' A' ' 16' ' ' PHE . 2.1 mp0 -85.77 -31.45 22.37 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.325 0.491 . . . . 64.53 112.325 -176.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 92.79 24.95 21.84 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 120.877 -0.678 . . . . 65.41 114.525 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -139.88 167.22 22.61 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 117.601 0.701 . . . . 73.44 112.282 177.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.566 ' N ' ' SD ' ' A' ' 56' ' ' MET . 1.2 mpt? -79.13 157.94 27.84 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.319 0.859 . . . . 73.33 113.319 -173.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 32.1 pt -142.03 135.02 28.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.01 -0.995 . . . . 64.14 109.586 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.446 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 24.0 mp0 -93.15 104.35 16.55 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.159 0.504 . . . . 72.54 111.574 -178.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.429 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -96.94 130.02 46.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 116.378 -0.373 . . . . 54.1 111.419 -177.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m -119.15 129.26 54.92 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.682 0.277 . . . . 71.11 111.434 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.403 HG12 ' HE1' ' A' ' 46' ' ' TYR . 25.9 pt -123.23 149.6 57.99 Favored Pre-proline 0 N--CA 1.471 0.611 0 CA-C-N 116.584 -0.28 . . . . 63.41 110.575 176.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.73 139.62 39.26 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.557 2.171 . . . . 71.25 113.226 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.2 -26.32 67.64 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 112.585 0.587 . . . . 73.02 112.585 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.4 t -63.8 -30.28 71.39 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.03 0.443 . . . . 64.4 111.3 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.0 t -72.18 130.41 86.38 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.216 -0.447 . . . . 72.24 110.708 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -43.66 131.88 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 123.175 2.584 . . . . 74.15 114.323 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.468 HD12 ' OH ' ' A' ' 46' ' ' TYR . 62.0 tp -58.37 137.68 57.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.996 -0.547 . . . . 72.31 111.201 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 68' ' ' LYS . 0.3 OUTLIER -75.05 125.95 30.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.198 0.523 . . . . 73.33 111.255 177.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -118.01 22.43 12.24 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.849 -0.614 . . . . 61.43 111.384 -175.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.419 ' CE2' ' HG3' ' A' ' 68' ' ' LYS . 26.0 m-85 -69.34 172.29 7.31 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.522 0.564 . . . . 64.41 112.522 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -86.43 174.93 8.66 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.879 -0.6 . . . . 72.32 111.576 -178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -74.21 135.66 42.76 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 110.012 -0.366 . . . . 61.22 110.012 176.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 95.0 m-20 60.56 20.97 10.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.799 0.44 . . . . 74.55 112.105 -174.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . -68.13 139.9 56.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.926 0.393 . . . . 70.1 111.663 178.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.601 ' HG3' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -68.1 111.13 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.073 -0.512 . . . . 74.21 111.145 179.342 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.9 m -129.41 147.92 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-O 121.362 0.601 . . . . 74.25 112.133 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -133.16 151.2 51.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.025 -0.534 . . . . 72.3 110.727 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -99.95 135.48 41.32 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.301 -0.409 . . . . 63.14 111.768 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.442 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.8 mp -67.77 -76.01 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 116.386 -0.37 . . . . 63.44 111.061 177.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -126.7 85.36 60.8 Favored Pre-proline 0 N--CA 1.472 0.648 0 CA-C-O 120.754 0.312 . . . . 73.45 110.951 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.27 156.19 14.63 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 123.219 2.613 . . . . 50.33 114.469 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.4 pt -142.81 123.11 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-N 115.82 -0.627 . . . . 75.54 110.32 171.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.0 126.88 30.87 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.354 -0.216 . . . . 64.15 110.929 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -65.64 147.54 53.23 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.193 0.52 . . . . 62.42 111.271 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 87.2 m -64.26 -55.89 18.33 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.978 -0.555 . . . . 71.33 112.287 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.7 m -146.53 91.38 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 120.941 0.401 . . . . 63.35 111.646 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.15 -23.72 65.75 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.269 0.47 . . . . 44.55 112.269 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.4 t -81.03 -9.07 59.89 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.009 0.433 . . . . 74.54 112.037 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -121.12 -45.0 2.37 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.202 0.445 . . . . 74.02 112.202 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 76.7 p -57.57 -54.08 50.9 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.236 0.541 . . . . 62.43 110.5 175.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -88.05 96.33 10.47 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.974 -0.751 . . . . 74.0 108.974 167.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -61.82 91.41 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.488 0.661 . . . . 74.24 112.495 -171.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -175.74 138.06 4.02 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.38 -0.827 . . . . 75.43 111.512 177.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.21 87.33 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.294 0.547 . . . . 41.01 112.424 -176.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -132.15 173.4 11.27 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.415 -0.357 . . . . 72.43 110.158 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' VAL . 8.3 p -135.66 0.17 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 N-CA-C 112.983 0.735 . . . . 62.15 112.983 -174.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.98 -171.05 2.72 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.641 -0.662 . . . . 63.34 110.151 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 -146.23 144.72 30.07 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.984 0.897 . . . . 65.21 113.309 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 37.6 m-85 -106.57 149.49 27.11 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.861 -1.063 . . . . 74.11 111.683 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.3 mt -130.37 108.02 15.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-N 116.227 -0.442 . . . . 74.13 110.311 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -77.99 129.25 35.06 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 122.295 -0.253 . . . . 72.14 111.139 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -130.65 151.71 50.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.29 0.478 . . . . 73.0 112.29 -176.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.1 -39.88 93.98 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.18 -0.464 . . . . 63.14 111.436 175.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -172.39 162.3 5.38 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.207 -0.451 . . . . 73.22 111.092 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.412 HG12 ' CD2' ' A' ' 78' ' ' LEU . 31.2 mt -122.42 117.43 52.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 115.938 -0.573 . . . . 72.53 110.839 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.9 m -122.34 -179.33 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.21 0.204 . . . . 74.2 111.232 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 88.4 mt -77.85 147.55 35.09 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 120.952 0.406 . . . . 74.3 111.943 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.8 m -72.55 143.12 48.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.358 0.503 . . . . 32.33 112.358 -177.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.45 46.24 1.36 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.792 0.664 . . . . 73.34 112.792 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 . . . . . 0 C--O 1.253 1.27 0 CA-C-O 118.746 -0.645 . . . . 75.3 111.58 177.638 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 111.71 0.263 . . . . 62.32 111.71 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.25 88.01 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.308 0.484 . . . . 62.41 112.308 -173.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.3 ptt180 54.11 -3.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.558 1.318 . . . . 73.21 114.558 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.3 mt -64.38 -53.18 52.55 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.795 -0.566 . . . . 73.22 111.365 -178.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.656 ' HB1' ' O ' ' A' ' 8' ' ' ILE . . . -115.6 -65.28 1.21 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.972 -0.558 . . . . 74.04 111.145 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 59.4 t30 64.13 -78.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.924 0.713 . . . . 75.34 112.924 174.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 -47.21 27.58 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 121.262 -0.494 . . . . 73.53 113.382 -176.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.656 ' O ' ' HB1' ' A' ' 5' ' ' ALA . 34.3 pt -129.61 -170.64 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 122.399 0.279 . . . . 70.23 110.398 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -148.48 131.63 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 120.835 0.35 . . . . 65.03 110.91 175.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.45 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.9 OUTLIER -125.67 -9.34 6.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.823 0.344 . . . . 75.21 111.713 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -84.09 -19.41 34.33 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 120.75 0.309 . . . . 73.44 111.816 175.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -125.95 125.22 42.37 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.919 0.34 . . . . 55.23 111.919 -176.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -72.93 104.4 4.06 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.913 0.387 . . . . 53.11 111.531 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.0 t -77.35 145.1 37.53 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.765 0.317 . . . . 72.14 111.204 176.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.2 p -114.67 136.74 52.72 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.997 0.427 . . . . 55.21 111.931 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -87.63 154.44 20.6 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.22 -0.445 . . . . 64.15 111.622 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -86.78 169.88 41.23 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.731 -0.747 . . . . 62.3 112.533 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -54.53 109.19 0.46 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.546 0.688 . . . . 73.44 111.495 178.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.5 mt -74.68 147.69 41.24 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.855 -0.612 . . . . 75.31 112.263 -173.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.569 ' HE3' ' HG2' ' A' ' 75' ' ' ARG . 47.4 mmtm -123.97 121.86 36.4 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 55.31 111.456 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -66.75 102.04 0.89 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.818 0.342 . . . . 74.2 110.581 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 21.9 t -89.61 -63.59 1.26 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 111.972 0.36 . . . . 60.21 111.972 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.29 -178.52 7.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.288 0.477 . . . . 62.11 112.288 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.6 tp -89.35 118.03 28.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.941 0.4 . . . . 62.15 110.896 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.8 -64.48 1.03 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.958 0.409 . . . . 75.41 111.748 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -164.71 136.85 4.52 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.36 -0.382 . . . . 75.22 111.335 -177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -97.9 101.46 12.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.803 0.335 . . . . 74.43 110.243 173.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' HB2' ' A' ' 42' ' ' LYS . 18.3 m -72.2 98.75 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 121.657 0.741 . . . . 64.14 111.327 -178.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 41' ' ' ILE . 85.6 mtt-85 -89.64 155.66 19.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.881 -0.6 . . . . 70.31 111.611 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.595 HG12 ' HE3' ' A' ' 42' ' ' LYS . 56.7 mt -68.85 106.66 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.995 -0.548 . . . . 71.34 111.258 -178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -85.61 123.93 31.58 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.839 0.352 . . . . 73.11 110.925 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -66.35 157.19 32.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.31 -0.405 . . . . 74.22 111.714 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -62.46 -25.84 68.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.077 0.465 . . . . 75.4 110.99 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -63.87 -15.84 59.92 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 116.021 -0.536 . . . . 74.4 111.611 175.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.64 -18.46 40.91 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-N 116.399 -0.364 . . . . 44.21 112.866 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.4 p -77.8 157.49 29.93 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.14 0.495 . . . . 70.43 111.876 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.0 t -102.4 134.85 42.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.459 -0.337 . . . . 73.54 111.28 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.4 t -90.77 155.3 18.89 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.833 0.349 . . . . 62.12 111.701 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.36 -30.51 69.6 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.161 0.505 . . . . 75.24 110.686 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.23 138.91 57.42 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.49 -0.777 . . . . 72.2 111.799 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.631 HG12 ' HG2' ' A' ' 29' ' ' ARG . 53.1 mt -115.9 138.17 47.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.943 0.401 . . . . 73.41 111.983 -175.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' HE3' HG12 ' A' ' 30' ' ' ILE . 32.8 mmtp -72.67 -57.18 4.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.444 0.64 . . . . 73.44 110.205 171.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HB3' ' HA ' ' A' ' 62' ' ' PRO . 8.9 pt-20 -163.92 166.15 21.99 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.489 -0.778 . . . . 60.24 111.563 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.531 HH12 ' HB2' ' A' ' 67' ' ' LEU . 31.2 mtp180 -114.3 118.34 33.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.464 -0.334 . . . . 74.44 111.5 -172.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 21.8 m -92.87 131.04 38.24 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 111.827 0.306 . . . . 71.12 111.827 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -120.48 143.78 48.35 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.01 0.433 . . . . 71.1 111.88 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -75.12 109.31 8.5 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.927 -0.579 . . . . 61.24 110.496 173.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.467 HD12 HG21 ' A' ' 59' ' ' VAL . 41.0 mt -111.93 131.99 55.03 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.354 0.597 . . . . 51.33 111.808 176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.6 mmtm -96.07 136.42 36.54 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.947 -0.569 . . . . 55.24 110.41 176.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.5 t -126.41 105.14 8.56 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 122.055 -0.403 . . . . 72.33 111.425 178.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -65.19 -40.06 93.69 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.865 0.364 . . . . 60.3 111.807 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.64 -23.06 48.55 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 121.219 -0.515 . . . . 71.4 114.205 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -112.54 -23.07 10.47 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 117.426 0.613 . . . . 64.52 111.934 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 87.94 -5.09 85.36 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.352 0.501 . . . . 72.25 114.352 175.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -118.44 172.55 7.39 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.572 0.701 . . . . 75.4 112.808 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 70.5 mtp -93.14 137.43 32.49 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.245 -0.889 . . . . 72.24 110.725 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.409 HG22 ' NE1' ' A' ' 98' ' ' TRP . 40.0 pt -121.64 138.71 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 120.956 0.407 . . . . 70.4 111.114 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.7 106.41 18.72 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.519 -0.309 . . . . 72.23 111.395 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 95.7 t -105.24 128.76 58.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.441 0.534 . . . . 74.24 112.441 -176.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -113.67 132.5 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.177 -0.465 . . . . 64.4 111.645 -178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -110.92 136.38 20.77 Favored Pre-proline 0 N--CA 1.474 0.764 0 CA-C-O 120.522 0.201 . . . . 65.04 111.073 175.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.523 ' HA ' ' HB3' ' A' ' 43' ' ' GLU . 33.3 Cg_endo -62.28 158.44 40.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.752 2.301 . . . . 72.12 113.33 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.99 -16.65 5.15 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.823 0.675 . . . . 72.34 112.823 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -68.86 -10.23 55.84 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.159 0.429 . . . . 45.21 112.159 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 44.8 t -108.82 129.75 23.57 Favored Pre-proline 0 CA--C 1.544 0.716 0 N-CA-C 112.261 0.467 . . . . 63.24 112.261 -176.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 28.9 Cg_exo -64.74 161.68 34.9 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.742 2.295 . . . . 70.25 113.072 174.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.531 ' HB2' HH12 ' A' ' 44' ' ' ARG . 62.7 tp -67.93 134.58 51.03 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.056 0.455 . . . . 74.35 112.103 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.48 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.91 108.64 17.02 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.291 -0.413 . . . . 75.33 111.027 174.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.75 78.67 9.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.049 0.452 . . . . 65.42 110.897 176.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -112.86 150.81 31.21 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.96 0.409 . . . . 63.31 111.2 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -77.34 171.16 15.31 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.327 0.584 . . . . 63.11 111.734 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -59.39 124.37 19.8 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.178 0.513 . . . . 35.12 111.917 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.427 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 94.4 m-20 63.36 35.42 12.28 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.731 -0.668 . . . . 65.43 112.135 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.86 137.36 57.15 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.367 . . . . 52.1 111.803 177.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.569 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 58.3 mtp180 -67.83 97.06 0.62 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.251 -0.431 . . . . 74.43 112.057 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 107' ' ' LEU . 33.9 m -122.04 176.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 121.325 0.583 . . . . 42.35 112.527 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -159.38 179.58 8.83 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.784 -0.644 . . . . 71.23 110.448 175.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.486 HD11 HG21 ' A' ' 59' ' ' VAL . 85.5 mt -115.45 149.44 38.03 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.579 0.585 . . . . 73.3 112.579 -173.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.563 HG22 ' ND2' ' A' ' 80' ' ' ASN . 48.7 mm -83.21 -73.16 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.893 -0.594 . . . . 70.2 111.094 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.563 ' ND2' HG22 ' A' ' 79' ' ' ILE . 51.1 m-80 -121.35 87.11 44.44 Favored Pre-proline 0 N--CA 1.477 0.885 0 O-C-N 122.244 -0.285 . . . . 72.35 111.527 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -82.01 136.04 9.0 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 122.928 2.419 . . . . 74.35 113.577 175.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 101' ' ' LYS . 35.8 pt -128.65 134.72 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 121.037 0.446 . . . . 71.04 111.399 172.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.56 111.93 15.11 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.45 -0.341 . . . . 61.11 110.11 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.457 ' OD1' HG13 ' A' ' 86' ' ' VAL . 6.2 t0 -102.8 153.78 19.84 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.123 0.487 . . . . 74.33 111.882 -172.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.1 p -115.3 5.27 14.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.117 -0.492 . . . . 74.12 112.246 -178.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.457 HG13 ' OD1' ' A' ' 84' ' ' ASP . 6.5 m -46.61 -31.78 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.483 0.92 . . . . 63.34 113.483 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.64 0.39 15.21 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.051 0.76 . . . . 44.34 113.051 -176.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -73.59 -5.75 42.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.627 0.602 . . . . 64.35 112.627 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -94.6 -56.95 2.62 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.438 0.532 . . . . 73.14 112.438 -177.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.8 t -78.63 -25.31 45.03 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 112.539 0.57 . . . . 73.12 112.539 -176.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -104.91 132.47 51.1 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.01 0.433 . . . . 65.34 111.657 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -79.01 44.85 0.58 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.186 -0.461 . . . . 54.1 111.139 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.68 105.14 2.73 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 121.511 -0.376 . . . . 73.42 112.407 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -114.0 43.46 1.84 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.169 0.509 . . . . 64.1 111.523 -176.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -83.85 10.88 8.57 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.568 0.581 . . . . 64.33 112.568 -174.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.441 HG13 ' H ' ' A' ' 97' ' ' ASP . 2.8 p -68.63 -55.66 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 N-CA-C 111.774 0.287 . . . . 74.33 111.774 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.441 ' H ' HG13 ' A' ' 96' ' ' VAL . 19.0 p-10 -148.58 106.26 3.68 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.625 0.726 . . . . 72.24 110.887 174.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.409 ' NE1' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -57.91 148.43 25.69 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.192 1.182 . . . . 75.32 114.192 -172.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -103.51 116.62 32.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.231 -0.895 . . . . 73.43 111.902 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.566 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 35.7 mt -105.73 104.42 16.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 115.353 -0.84 . . . . 64.1 110.692 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 82' ' ' ILE . 4.7 mtpm? -86.6 121.83 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 122.106 -0.371 . . . . 73.12 110.204 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.46 161.46 19.55 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.321 0.86 . . . . 61.42 113.321 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 21.5 t70 -63.91 -55.18 24.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.327 -0.851 . . . . 72.55 111.652 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -158.09 159.11 35.92 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.963 0.411 . . . . 73.11 111.364 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.48 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 57.0 mt -116.71 121.7 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.081 -0.509 . . . . 63.44 111.15 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 30.8 m -124.36 -179.13 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.401 -0.363 . . . . 74.44 110.832 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.437 ' HA ' ' HA ' ' A' ' 76' ' ' VAL . 93.9 mt -80.86 151.22 28.77 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.091 -0.381 . . . . 70.51 111.327 177.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 26.1 m -63.86 125.45 24.43 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.259 0.466 . . . . 73.41 112.259 -176.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -80.44 108.08 13.77 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.996 -0.547 . . . . 74.21 111.372 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 . . . . . 0 C--O 1.256 1.398 0 N-CA-C 111.981 0.363 . . . . 64.31 111.981 179.753 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 120.823 0.344 . . . . 73.43 111.538 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -158.58 162.15 37.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.435 -0.348 . . . . 71.31 110.91 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.452 ' H ' ' NE ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -89.45 -3.37 58.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.099 0.407 . . . . 74.34 112.099 -179.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.3 mm? -74.82 141.39 44.3 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.715 0.293 . . . . 65.24 111.305 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 65.3 11.52 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.638 0.607 . . . . 61.22 112.638 -179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -71.98 -43.06 65.73 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.887 0.375 . . . . 61.13 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -174.43 94.75 0.1 OUTLIER Glycine 0 CA--C 1.526 0.771 0 C-N-CA 121.295 -0.478 . . . . 73.44 112.743 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.6 pt -134.69 170.01 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.937 0.398 . . . . 62.52 111.599 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -80.77 105.54 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.963 0.411 . . . . 60.51 111.002 177.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.574 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.0 pt? -51.59 -44.82 62.94 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.308 0.855 . . . . 72.22 113.308 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -162.57 170.08 19.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.075 0.464 . . . . 73.54 111.806 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -157.57 101.69 1.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.99 -0.55 . . . . 75.22 111.982 173.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 72.62 -53.48 0.7 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.868 0.867 . . . . 73.45 113.241 176.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.1 p -56.45 106.28 0.27 Allowed 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.152 0.427 . . . . 71.41 112.152 -178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 t -85.88 99.35 11.34 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.453 0.644 . . . . 64.14 111.749 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.423 ' HZ ' ' HH2' ' A' ' 98' ' ' TRP . 55.4 m-85 -84.29 117.24 23.44 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.229 -0.441 . . . . 73.14 111.473 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.652 ' HA3' ' HA3' ' A' ' 52' ' ' GLY . . . -71.34 175.69 39.36 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.104 -0.569 . . . . 41.2 112.73 176.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -53.33 112.37 0.87 Allowed 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 121.451 0.643 . . . . 74.23 112.261 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 69.8 mt -85.32 133.87 34.13 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.599 -0.728 . . . . 73.22 110.743 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 90.2 mttt -126.66 127.37 45.07 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.094 0.474 . . . . 73.45 112.157 -179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -67.35 136.06 54.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.88 -0.6 . . . . 74.31 111.532 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.2 p -113.51 -63.51 1.44 Allowed 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.989 -0.445 . . . . 73.0 111.229 174.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.78 -173.95 4.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.077 0.465 . . . . 52.43 111.759 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 60.4 tp -92.7 124.43 36.71 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.469 -0.332 . . . . 73.43 110.764 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 25' ' ' ARG . 4.1 tpp180 -75.84 -58.1 3.48 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.864 0.364 . . . . 73.43 111.942 -177.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -168.55 141.14 2.88 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.024 0.44 . . . . 72.34 111.817 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.9 mt-10 -101.2 98.36 8.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.714 -0.476 . . . . 75.31 109.714 171.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 m -70.15 110.8 3.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.356 0.598 . . . . 74.52 110.209 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 81.7 mtt180 -100.34 156.32 17.31 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.513 0.56 . . . . 73.41 112.513 -171.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.2 mt -62.73 115.43 2.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 115.733 -0.667 . . . . 63.34 111.844 -174.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -88.67 119.17 28.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.278 -0.419 . . . . 73.45 110.92 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -60.59 159.91 9.9 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.062 0.458 . . . . 73.12 111.619 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.76 -18.03 52.37 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.098 -0.501 . . . . 71.45 111.905 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -83.36 -0.11 48.35 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.185 0.439 . . . . 70.51 112.185 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -11.22 70.72 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.169 -0.539 . . . . 75.45 113.726 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -86.98 152.19 22.61 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.418 -0.46 . . . . 60.1 111.606 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.4 t -95.04 125.62 47.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 120.952 0.406 . . . . 60.34 111.455 -178.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -79.73 176.39 9.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.355 0.598 . . . . 54.33 111.973 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -83.68 -23.41 31.73 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.029 -0.532 . . . . 74.31 111.208 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.61 143.7 54.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.895 0.379 . . . . 74.23 111.11 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.505 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.1 mt -101.14 141.56 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 121.045 0.45 . . . . 60.55 112.16 -174.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -82.53 -50.86 8.36 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.396 0.617 . . . . 72.12 109.903 174.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -165.98 159.94 16.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.426 -0.806 . . . . 51.11 110.982 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.8 mtt180 -107.58 123.59 48.69 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.073 0.397 . . . . 72.23 112.073 -175.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 56.5 m -96.24 114.07 25.72 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.739 0.304 . . . . 74.13 111.382 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -101.04 156.16 17.57 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.959 0.409 . . . . 71.5 111.762 178.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.543 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 26.8 m-20 -97.65 116.78 30.52 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.033 -0.53 . . . . 72.55 111.827 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.508 HD12 HG21 ' A' ' 59' ' ' VAL . 66.9 mt -118.86 126.77 52.56 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.05 0.453 . . . . 73.13 111.003 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HD2' ' HG3' ' A' ' 56' ' ' MET . 0.5 OUTLIER -104.74 115.49 30.41 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.978 0.418 . . . . 72.01 111.272 178.603 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -80.01 105.32 11.2 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.902 0.382 . . . . 65.14 110.805 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 38.8 mmtm -79.14 -21.33 46.69 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.793 0.33 . . . . 75.43 111.591 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.652 ' HA3' ' HA3' ' A' ' 17' ' ' GLY . . . -68.19 -47.03 61.27 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.038 -0.601 . . . . 74.55 112.984 176.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -96.75 -32.43 12.15 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 122.494 -0.416 . . . . 64.34 111.664 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 91.54 39.62 5.56 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.276 -0.488 . . . . 43.23 113.921 177.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -136.62 160.46 38.74 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.293 0.568 . . . . 75.43 112.319 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.562 ' HG3' ' HD2' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -94.98 133.3 38.89 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.69 -0.686 . . . . 64.12 111.616 178.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.7 pt -126.3 141.53 45.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 120.636 0.255 . . . . 74.45 111.084 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -105.19 111.36 24.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.032 0.444 . . . . 75.14 110.844 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 48' ' ' LEU . 92.7 t -101.98 137.59 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 116.385 -0.37 . . . . 62.43 111.446 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 89.0 p -124.65 128.81 49.43 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.292 0.568 . . . . 61.22 112.048 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.499 HG21 HG13 ' A' ' 105' ' ' ILE . 29.0 pt -118.91 153.92 52.84 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 115.829 -0.623 . . . . 72.11 110.69 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.43 153.28 55.29 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.406 2.071 . . . . 72.11 113.399 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.8 -16.92 60.17 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.152 0.427 . . . . 71.34 112.152 -178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 74.5 p -66.27 -18.8 65.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.841 0.353 . . . . 75.33 111.601 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.7 t -95.37 124.32 53.8 Favored Pre-proline 0 CA--C 1.545 0.771 0 CA-C-N 116.562 -0.29 . . . . 74.2 111.303 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.37 169.29 18.76 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.0 2.467 . . . . 61.11 114.141 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.0 tp -70.85 128.82 37.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.908 -0.587 . . . . 73.32 111.513 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.41 114.72 23.41 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.262 0.553 . . . . 71.32 112.294 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.96 51.91 1.42 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 115.716 -0.674 . . . . 61.2 111.205 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -76.71 159.03 30.53 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.325 0.584 . . . . 75.11 112.108 -177.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -77.03 148.26 36.29 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.886 -0.597 . . . . 63.0 111.334 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -59.85 119.27 7.38 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.87 0.367 . . . . 74.41 111.521 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.477 HD22 ' N ' ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.99 24.83 3.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.319 0.648 . . . . 72.31 112.387 179.119 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.97 137.3 43.44 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.549 -0.296 . . . . 52.31 110.577 171.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 19' ' ' LEU . 76.2 mtm-85 -66.85 126.62 29.64 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.75 0.31 . . . . 74.12 111.44 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.549 HG12 HD23 ' A' ' 107' ' ' LEU . 27.1 m -129.13 151.53 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 121.285 0.564 . . . . 60.31 112.328 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.67 157.86 43.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.182 -0.463 . . . . 73.04 110.445 174.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.8 mt -106.02 141.87 36.68 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.093 0.775 . . . . 74.23 113.093 -170.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.529 HG22 ' ND2' ' A' ' 80' ' ' ASN . 38.8 mm -97.22 118.17 43.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.619 -0.718 . . . . 72.4 110.115 174.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.529 ' ND2' HG22 ' A' ' 79' ' ' ILE . 45.4 m-80 61.55 58.33 3.15 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 123.154 0.581 . . . . 71.12 111.962 -173.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -81.82 132.52 7.6 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.753 2.302 . . . . 73.31 113.745 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.1 pt -139.36 142.22 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-O 120.764 0.316 . . . . 74.53 111.241 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.03 123.16 24.67 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 122.246 -0.284 . . . . 65.22 110.697 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -73.75 145.5 45.05 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.09 0.471 . . . . 62.22 111.057 -175.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 80.2 p -105.98 5.12 30.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.25 -0.432 . . . . 53.42 111.9 -178.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.7 p -78.99 151.27 5.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.721 0.296 . . . . 43.33 111.123 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.466 ' HB1' ' CE1' ' A' ' 91' ' ' TYR . . . 71.5 -7.36 1.22 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.661 0.986 . . . . 74.34 113.661 173.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.5 p -56.27 -37.61 70.04 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.43 0.53 . . . . 75.4 112.43 -177.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.26 -11.68 34.63 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.013 0.375 . . . . 45.3 112.013 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 38.8 m -82.33 -38.22 24.59 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.938 0.399 . . . . 74.11 111.633 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.466 ' CE1' ' HB1' ' A' ' 87' ' ' ALA . 3.7 m-85 -75.75 -178.84 4.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.638 0.607 . . . . 64.52 112.638 -176.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.647 ' HB2' ' HB3' ' A' ' 95' ' ' ASP . 63.5 mm-40 -97.51 -179.44 4.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.63 0.604 . . . . 45.53 112.63 -169.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.73 -48.81 79.18 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-N 115.941 -0.572 . . . . 54.31 114.226 -176.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.96 -1.79 13.72 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 122.349 -0.5 . . . . 54.32 111.921 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 92' ' ' GLN . 27.0 t70 -101.69 102.6 13.29 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.872 0.323 . . . . 61.11 111.872 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.402 ' O ' HG13 ' A' ' 96' ' ' VAL . 9.2 p -178.79 114.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 112.623 0.601 . . . . 75.42 112.623 173.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -97.0 107.85 20.46 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.191 -0.67 . . . . 64.45 109.191 167.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.423 ' HH2' ' HZ ' ' A' ' 16' ' ' PHE . 1.5 p-90 -62.32 160.18 13.73 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.464 1.283 . . . . 62.42 114.464 -167.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -114.86 144.94 42.74 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.258 -1.337 . . . . 75.21 111.423 -174.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.494 ' HB ' HG22 ' A' ' 59' ' ' VAL . 61.0 mt -129.65 122.1 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.332 -0.395 . . . . 74.51 110.97 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -89.27 149.14 23.2 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 122.081 -0.387 . . . . 73.41 110.702 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.61 161.18 42.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.799 0.333 . . . . 65.44 111.496 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.423 ' HB3' HD22 ' A' ' 80' ' ' ASN . 30.8 t70 -84.87 -30.93 24.05 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.945 0.402 . . . . 71.44 110.986 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.417 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 25.3 t0 -161.19 153.94 20.76 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.399 0.619 . . . . 61.21 112.045 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.499 HG13 HG21 ' A' ' 61' ' ' ILE . 62.0 mt -115.11 114.18 45.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.515 -0.766 . . . . 72.54 111.178 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.2 m -123.89 178.54 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.834 0.349 . . . . 43.54 111.599 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.549 HD23 HG12 ' A' ' 76' ' ' VAL . 98.0 mt -85.12 146.33 27.19 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.785 0.326 . . . . 74.31 111.68 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 16.1 m -65.13 149.42 49.93 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.805 0.336 . . . . 74.33 111.152 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.0 mt -75.95 38.8 0.17 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.816 0.673 . . . . 70.41 112.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 118.993 -0.527 . . . . 72.05 111.079 174.754 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 ptp . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.897 0.379 . . . . 71.35 111.449 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.4 mmt -104.19 157.03 17.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.301 0.572 . . . . 70.31 111.674 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -95.26 96.82 9.43 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.205 -0.452 . . . . 74.11 111.07 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.411 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.3 mm? -82.23 130.92 35.21 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.51 -0.314 . . . . 65.11 111.103 178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.65 165.51 24.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.536 -0.302 . . . . 41.3 111.38 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -58.24 -59.28 5.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.106 0.409 . . . . 51.24 112.106 -177.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 66.51 24.8 72.55 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.956 -0.64 . . . . 73.13 112.819 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 11' ' ' ASP . 19.8 pt -99.18 159.5 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.132 0.492 . . . . 62.21 111.956 -176.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 61.2 t -119.24 -62.36 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 121.186 0.517 . . . . 72.43 110.948 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.7 mt -98.08 -54.76 2.98 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.175 0.512 . . . . 54.41 110.819 179.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.454 ' O ' HD12 ' A' ' 8' ' ' ILE . 3.7 m-20 -54.72 92.26 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.193 -0.912 . . . . 74.24 112.243 -179.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -129.8 -176.56 3.96 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.153 0.501 . . . . 61.21 111.308 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -88.02 124.49 33.79 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.951 0.405 . . . . 64.14 110.049 172.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.405 ' HB ' ' CE2' ' A' ' 16' ' ' PHE . 23.4 p -64.73 -19.7 65.93 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.468 0.544 . . . . 72.3 112.468 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 47.8 m 61.89 81.51 0.19 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.426 0.632 . . . . 72.24 112.343 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.405 ' CE2' ' HB ' ' A' ' 14' ' ' THR . 63.9 m-85 -132.83 136.19 46.1 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.949 -0.569 . . . . 64.12 110.888 174.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -97.52 -92.63 1.91 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 120.924 -0.655 . . . . 51.05 112.261 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.411 ' HG2' ' HD2' ' A' ' 20' ' ' LYS . 37.2 tt0 -90.27 108.84 20.01 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.923 0.392 . . . . 74.41 111.624 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.6 mt -107.78 129.72 55.03 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 110.156 -0.313 . . . . 44.52 110.156 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.605 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 0.0 OUTLIER -118.62 139.94 50.71 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.351 0.5 . . . . 73.25 112.351 -177.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -77.13 142.6 39.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.926 -0.579 . . . . 62.11 111.282 176.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 46.3 t -123.72 -62.69 1.28 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.253 -0.431 . . . . 72.3 111.454 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.63 174.54 15.19 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.127 0.489 . . . . 70.33 111.858 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.8 tp -87.85 113.43 23.5 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.012 -0.54 . . . . 73.13 110.984 177.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 25' ' ' ARG . 11.6 tpp85 -61.44 -58.13 9.44 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.744 0.307 . . . . 64.34 111.443 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -176.71 143.08 0.44 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.413 0.523 . . . . 74.43 112.413 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -101.21 98.27 8.69 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.29 -0.633 . . . . 65.13 109.29 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 42' ' ' LYS . 30.0 m -77.46 126.6 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-O 120.898 0.38 . . . . 62.4 111.756 -175.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.572 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.5 mtt180 -96.03 158.26 15.52 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.89 0.376 . . . . 71.54 111.525 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mt -72.3 139.93 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 116.115 -0.493 . . . . 74.2 111.006 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -107.16 122.71 47.04 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.982 -0.449 . . . . 71.24 111.359 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -72.17 167.4 20.39 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.299 0.571 . . . . 51.44 112.22 -176.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.92 -24.75 64.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.969 -0.559 . . . . 63.42 111.592 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -65.15 -14.06 59.66 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.002 0.429 . . . . 63.51 111.932 176.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.55 -3.24 83.49 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.13 -0.557 . . . . 74.4 112.535 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -98.3 148.73 23.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.212 0.53 . . . . 74.4 111.764 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.98 141.93 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.889 -0.596 . . . . 72.14 111.599 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -90.51 169.61 10.89 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.073 -0.512 . . . . 74.42 112.205 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -76.73 -26.96 55.22 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.812 -0.631 . . . . 73.14 110.895 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -77.42 146.21 36.7 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.614 0.721 . . . . 63.44 111.93 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 52.0 mt -99.46 144.83 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.591 -0.731 . . . . 73.31 111.068 -176.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.559 ' HB3' HG23 ' A' ' 28' ' ' VAL . 27.7 tptp -82.91 -57.62 3.22 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.304 -0.407 . . . . 64.53 111.076 177.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -168.38 160.93 11.67 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.916 0.388 . . . . 72.22 111.494 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -107.84 125.96 52.08 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.879 0.371 . . . . 75.31 111.912 -175.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -107.45 121.19 44.12 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.183 -0.462 . . . . 70.13 112.145 -176.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -108.64 152.68 24.47 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.688 0.395 . . . . 75.32 111.989 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.643 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 11.9 m-20 -97.63 111.66 23.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.709 0.633 . . . . 73.44 112.709 177.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 42.1 mt -114.65 128.49 56.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.982 -0.553 . . . . 64.05 110.344 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.643 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 2.4 mptp? -120.29 145.95 46.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.957 0.408 . . . . 71.43 111.592 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -112.41 131.02 55.77 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.859 176.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -82.38 169.78 16.06 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.901 0.381 . . . . 74.1 111.807 -177.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.29 -74.86 1.01 Allowed Glycine 0 CA--C 1.524 0.602 0 C-N-CA 121.275 -0.488 . . . . 71.5 112.724 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.484 ' HG3' ' HG3' ' A' ' 55' ' ' ARG . 6.9 tp-100 -65.11 -28.84 69.72 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.16 0.505 . . . . 73.23 110.291 174.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.58 52.6 33.51 Favored Glycine 0 CA--C 1.526 0.738 0 CA-C-N 115.874 -0.603 . . . . 65.31 114.317 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.484 ' HG3' ' HG3' ' A' ' 53' ' ' GLN . 49.9 mtt180 -122.53 135.55 54.67 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.264 -0.551 . . . . 64.44 111.194 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 18.9 ptt? -111.37 141.25 45.16 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.077 -0.511 . . . . 63.12 111.516 -176.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 22.4 pt -133.49 137.32 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 116.164 -0.471 . . . . 72.03 111.565 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.07 114.09 26.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.784 0.326 . . . . 73.51 110.84 175.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 87.7 t -94.97 119.32 42.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.771 0.319 . . . . 62.14 111.573 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.6 m -108.68 114.76 28.83 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.999 0.428 . . . . 53.13 111.894 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.5 pt -108.09 154.09 41.41 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.117 -0.492 . . . . 74.3 111.079 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.57 146.78 51.74 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.747 2.298 . . . . 60.33 113.486 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.25 64.72 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.128 0.788 . . . . 72.12 113.128 -175.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 t -68.99 -19.21 64.14 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.998 0.428 . . . . 73.12 111.386 177.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.3 t -87.1 127.08 60.68 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.406 -0.361 . . . . 74.14 110.864 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.5 177.94 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.722 2.281 . . . . 72.23 113.886 -176.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.0 tp -79.92 126.51 31.1 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.794 -0.639 . . . . 63.42 111.894 -175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -80.61 122.85 27.58 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.2 0.524 . . . . 75.42 111.74 176.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -101.31 76.88 1.74 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.129 0.49 . . . . 42.31 111.075 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -90.04 -172.51 3.53 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.134 0.492 . . . . 73.25 112.126 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -118.11 161.6 19.57 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 116.275 -0.42 . . . . 72.44 111.384 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.34 124.39 20.78 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 120.873 0.368 . . . . 70.33 111.276 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.605 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 41.9 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 112.74 0.645 . . . . 73.21 112.74 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.66 124.91 25.39 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 122.302 -0.249 . . . . 31.45 110.88 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -63.21 122.48 16.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.052 0.453 . . . . 54.33 111.527 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.473 HG12 HD23 ' A' ' 107' ' ' LEU . 27.6 m -126.14 140.18 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.12 0.486 . . . . 74.4 111.291 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.405 ' OE2' ' HA ' ' A' ' 108' ' ' THR . 12.7 pt-20 -121.75 152.6 39.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.302 0.572 . . . . 73.11 111.126 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.6 mt -101.19 145.39 28.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.884 -0.598 . . . . 63.42 111.378 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -75.48 -70.98 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.561 -0.29 . . . . 74.02 110.664 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -122.81 86.03 50.01 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-O 120.72 0.295 . . . . 72.42 111.477 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.55 150.14 14.77 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.976 2.45 . . . . 60.32 113.502 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.1 pt -140.97 132.36 28.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 73.11 110.637 171.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.96 125.02 28.83 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 116.575 -0.284 . . . . 64.03 110.96 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -83.19 121.58 27.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.148 0.499 . . . . 73.41 111.105 -177.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.1 p -113.2 -1.04 14.44 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.08 -0.509 . . . . 71.42 111.68 178.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.4 m -92.48 -13.65 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 N-CA-C 112.121 0.415 . . . . 74.11 112.121 -175.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.09 20.11 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.054 0.454 . . . . 42.4 112.07 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.1 p -76.09 46.98 0.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 122.97 0.508 . . . . 40.41 112.202 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.43 104.45 3.92 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.205 -0.31 . . . . 22.15 111.584 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.0 m 72.97 -45.57 0.63 Allowed 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 113.079 0.77 . . . . 70.52 113.079 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -56.11 -47.78 77.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.904 0.705 . . . . 75.34 112.904 -173.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -145.84 130.76 18.18 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.224 -0.298 . . . . 75.42 111.439 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -98.7 -34.02 5.38 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 121.301 -0.476 . . . . 45.34 113.41 177.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.03 152.2 19.44 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.923 0.392 . . . . 74.41 111.699 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.11 101.45 5.33 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 121.042 0.449 . . . . 71.3 111.924 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 34.5 m -119.35 -161.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 116.355 -0.384 . . . . 72.45 111.467 -178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -61.74 117.74 6.22 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.338 0.59 . . . . 72.04 111.301 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 8.8 p-90 -98.44 172.26 7.64 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.031 0.752 . . . . 73.43 113.031 -172.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -112.68 140.43 47.45 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.134 0.79 . . . . 65.24 113.134 -172.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 57.2 mt -123.33 113.46 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.209 -0.905 . . . . 75.33 110.39 173.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -84.39 136.22 33.96 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.157 -0.339 . . . . 73.01 110.246 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.94 164.48 30.07 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.263 0.838 . . . . 53.44 113.263 -173.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -72.54 -66.65 0.63 Allowed 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.259 -0.882 . . . . 73.51 111.183 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -141.37 162.46 35.43 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.084 0.468 . . . . 74.25 111.572 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 37.4 mt -125.87 121.46 59.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.812 -0.631 . . . . 55.11 110.979 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.1 m -130.99 172.15 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-O 120.745 0.307 . . . . 71.01 111.55 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.473 HD23 HG12 ' A' ' 76' ' ' VAL . 92.3 mt -76.74 135.82 39.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.602 0.239 . . . . 71.33 111.25 177.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 110' ' ' GLU . 6.2 m -67.2 134.69 52.2 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.512 -0.313 . . . . 70.2 111.371 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.33 3.95 9.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 112.214 0.45 . . . . 62.11 112.214 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.469 ' H ' HG22 ' A' ' 108' ' ' THR . 31.8 mm-40 . . . . . 0 C--O 1.253 1.26 0 CA-C-O 118.732 -0.651 . . . . 72.44 112.136 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 112.323 0.49 . . . . 74.32 112.323 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.6 mmt -111.89 178.66 4.24 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.147 -0.345 . . . . 73.41 111.606 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.444 HH11 ' HD3' ' A' ' 3' ' ' ARG . 15.5 ttm180 -93.48 97.89 10.83 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.858 0.361 . . . . 65.21 111.375 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.494 ' HG ' HD13 ' A' ' 8' ' ' ILE . 3.1 mm? -120.59 173.41 7.2 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.971 0.415 . . . . 50.22 111.034 177.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -137.25 -69.4 0.46 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.875 0.369 . . . . 73.41 111.929 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -155.42 175.55 13.73 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.882 0.372 . . . . 72.41 111.529 -177.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.0 -29.11 4.77 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.307 -0.473 . . . . 40.1 113.374 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.494 HD13 ' HG ' ' A' ' 4' ' ' LEU . 43.8 pt -81.12 -179.75 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.178 0.513 . . . . 61.12 112.099 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 9' ' ' VAL . 5.6 p -73.75 89.76 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.79 0.805 . . . . 74.32 110.974 174.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.625 HD12 ' N ' ' A' ' 11' ' ' ASP . 1.6 pp -77.1 -31.65 56.04 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.962 -0.563 . . . . 75.32 111.831 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.625 ' N ' HD12 ' A' ' 10' ' ' LEU . 21.7 t0 46.59 63.84 1.75 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.421 0.629 . . . . 64.41 111.512 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -101.14 127.65 47.58 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.8 -0.636 . . . . 70.15 112.006 -172.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.17 94.78 0.53 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.652 0.263 . . . . 73.32 111.207 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 8.1 t -71.69 -33.21 68.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.944 0.402 . . . . 62.4 111.364 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 m -113.72 124.98 53.58 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.254 -0.43 . . . . 55.4 110.537 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -79.71 140.17 37.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.775 0.322 . . . . 70.24 111.648 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.87 -178.27 17.23 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 120.981 -0.628 . . . . 61.51 112.599 173.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.88 130.85 30.21 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.582 0.706 . . . . 73.11 112.632 -178.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 mt -94.67 148.11 22.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.791 -0.64 . . . . 70.41 110.987 -178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 73' ' ' ASN . 61.1 mttp -114.31 118.17 33.16 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.093 0.473 . . . . 61.13 112.082 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.39 115.07 13.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.029 -0.532 . . . . 72.33 111.391 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.2 p -99.25 -60.87 1.45 Allowed 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.075 0.398 . . . . 63.1 112.075 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.25 177.88 10.57 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.863 0.69 . . . . 65.2 112.863 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.3 tp -81.98 119.52 24.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.477 -0.783 . . . . 74.51 110.604 173.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 8.5 tpt180 -74.89 -55.76 5.46 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.064 0.394 . . . . 72.43 112.064 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -170.67 143.1 2.11 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.897 0.332 . . . . 72.41 111.897 -174.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -110.49 118.96 37.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.747 0.308 . . . . 73.3 110.588 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 25.9 m -96.73 117.71 41.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 121.021 0.439 . . . . 65.33 110.619 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.615 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 78.5 mtt180 -91.76 179.52 5.61 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.363 0.601 . . . . 75.22 112.511 -175.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.0 mt -97.83 114.22 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.633 -0.712 . . . . 64.45 110.989 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.3 tt0 -81.28 130.2 34.93 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.284 0.564 . . . . 73.22 111.527 -179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.453 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.4 m-20 -80.63 145.78 31.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.792 -0.64 . . . . 74.01 110.682 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -63.36 -18.12 63.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.118 0.485 . . . . 73.33 111.166 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.35 -17.91 63.09 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.937 -0.574 . . . . 72.43 111.703 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.01 -49.15 0.89 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.379 -0.439 . . . . 55.24 113.175 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.5 m -74.45 155.92 37.52 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.067 0.461 . . . . 75.41 111.638 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.542 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 40.4 t -96.39 124.33 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.489 -0.323 . . . . 75.42 111.314 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.453 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 47.8 t -59.68 164.46 3.62 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.809 0.67 . . . . 54.15 112.809 -177.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.615 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 10.2 m-20 -81.56 -2.72 51.02 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.963 -0.562 . . . . 74.02 110.659 171.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.85 124.84 27.59 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.057 -0.52 . . . . 74.1 109.949 170.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 48.9 mt -95.46 140.88 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.748 0.309 . . . . 73.53 110.854 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -87.27 -59.55 2.22 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.724 0.297 . . . . 62.22 110.963 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -137.64 161.05 37.5 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.402 0.62 . . . . 71.52 111.772 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -132.61 111.24 11.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.68 -0.691 . . . . 65.35 110.856 -177.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 31.0 m -95.14 131.65 40.92 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.409 0.522 . . . . 74.23 112.409 -175.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -113.33 152.2 30.22 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 122.772 0.429 . . . . 72.33 111.444 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.516 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 48.8 m-20 -88.11 110.11 20.4 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.283 -0.417 . . . . 73.31 111.217 174.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.652 HD12 HG21 ' A' ' 59' ' ' VAL . 41.2 mt -114.53 130.63 56.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.993 0.425 . . . . 62.14 110.847 174.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 44.0 mmtm -87.29 118.03 26.44 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.83 0.348 . . . . 74.34 110.832 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t -95.15 146.37 24.36 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.323 0.582 . . . . 73.34 112.399 -176.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -89.51 2.72 54.21 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.904 -0.589 . . . . 63.33 111.387 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 -107.76 0.07 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.159 -0.543 . . . . 63.11 113.24 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -78.84 14.01 1.51 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 122.153 -0.616 . . . . 75.23 112.43 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.84 -5.13 49.78 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.007 -0.616 . . . . 61.14 113.788 177.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -78.7 146.78 33.78 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.974 0.416 . . . . 74.45 111.696 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -70.07 132.75 46.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.038 -0.528 . . . . 51.41 109.815 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.455 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 34.0 pt -103.48 118.11 50.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.126 0.489 . . . . 62.05 110.838 177.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -87.4 104.33 16.34 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.097 0.475 . . . . 74.42 109.741 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.652 HG21 HD12 ' A' ' 48' ' ' LEU . 90.3 t -94.39 119.74 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-O 121.105 0.479 . . . . 74.31 112.25 -172.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.2 m -106.7 121.97 45.41 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.994 -0.548 . . . . 71.24 111.29 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.451 HG21 HG13 ' A' ' 105' ' ' ILE . 36.9 pt -119.33 145.91 39.68 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 116.657 -0.247 . . . . 65.41 110.62 174.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.47 134.64 64.8 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.113 1.875 . . . . 75.21 112.261 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.76 -7.17 6.99 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.805 0.669 . . . . 65.25 112.805 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.5 p -70.46 -20.06 62.91 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 120.719 0.295 . . . . 51.22 110.883 173.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.5 t -82.1 133.47 51.07 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 115.981 -0.554 . . . . 65.21 110.747 175.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -49.64 151.19 7.9 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.14 2.56 . . . . 63.44 114.421 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 68.2 tp -63.96 136.34 57.26 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.926 -0.579 . . . . 73.2 112.197 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -92.52 125.21 37.06 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.15 0.5 . . . . 45.43 111.339 175.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -113.29 72.01 0.76 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.923 -0.58 . . . . 74.51 111.007 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -102.87 170.32 8.06 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.412 0.625 . . . . 72.4 111.856 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.6 168.34 10.59 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.54 -0.755 . . . . 74.31 111.496 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.23 130.68 44.05 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.912 0.387 . . . . 71.13 111.851 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.419 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 96.3 m-20 62.12 21.98 12.8 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.225 0.61 . . . . 71.31 112.222 -177.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.16 127.95 34.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.621 0.248 . . . . 70.12 111.038 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -62.05 116.26 4.78 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.125 0.488 . . . . 75.24 111.593 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 HD23 ' A' ' 107' ' ' LEU . 29.5 m -129.09 152.87 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.073 -0.512 . . . . 73.33 111.888 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.08 152.55 50.98 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.086 0.469 . . . . 73.12 110.461 173.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.0 mt -98.19 144.96 27.09 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.167 0.803 . . . . 60.11 113.167 -170.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.47 HG22 HD22 ' A' ' 80' ' ' ASN . 47.6 mm -92.37 113.51 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 CA-C-N 115.378 -0.828 . . . . 75.44 110.31 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.47 HD22 HG22 ' A' ' 79' ' ' ILE . 51.1 m-80 48.3 67.69 4.25 Favored Pre-proline 0 N--CA 1.48 1.041 0 N-CA-C 112.776 0.658 . . . . 71.24 112.776 -176.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.49 146.27 15.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.869 2.379 . . . . 71.42 113.429 177.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 46.8 pt -136.81 140.95 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 122.659 0.384 . . . . 72.52 111.002 176.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.35 124.9 25.31 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.188 -0.32 . . . . 61.32 110.709 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -64.17 104.63 0.76 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.469 0.652 . . . . 33.54 111.25 -175.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.8 t -81.31 -34.8 31.67 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.724 -0.671 . . . . 75.44 112.483 -178.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.473 ' O ' HG22 ' A' ' 90' ' ' THR . 21.6 m -70.14 -35.86 65.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 N-CA-C 111.942 0.349 . . . . 73.41 111.942 -174.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.62 -54.36 46.88 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 111.724 0.268 . . . . 70.42 111.724 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.8 t -73.67 -26.51 60.77 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 111.872 0.323 . . . . 70.34 111.872 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.42 -40.9 98.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.816 0.341 . . . . 50.04 111.369 177.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.473 HG22 ' O ' ' A' ' 86' ' ' VAL . 10.2 t -90.68 -35.92 14.65 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 111.81 0.3 . . . . 73.55 111.81 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -104.97 99.1 8.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.943 0.402 . . . . 74.55 110.913 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.418 ' CD ' ' H ' ' A' ' 92' ' ' GLN . 0.8 OUTLIER -86.66 -5.69 59.06 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.493 -0.321 . . . . 74.01 111.844 -178.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -75.03 161.17 53.18 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 121.251 -0.5 . . . . 73.25 113.235 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.49 -3.28 58.99 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.478 -0.425 . . . . 74.01 112.11 -178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -56.75 -45.02 82.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.772 0.429 . . . . 54.04 112.074 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 49.0 t -83.45 113.65 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 N-CA-C 112.109 0.411 . . . . 61.03 112.109 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -71.42 159.2 34.96 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 109.238 -0.653 . . . . 63.13 109.238 172.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.455 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -78.89 142.47 36.75 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 122.309 1.052 . . . . 75.53 113.681 -166.428 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -107.08 148.38 28.85 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.741 -1.118 . . . . 65.4 111.237 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 38.2 mt -123.53 113.54 37.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 110.052 -0.351 . . . . 50.11 110.052 174.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -85.35 132.64 34.21 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 122.224 -0.297 . . . . 54.44 110.691 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -127.13 151.14 49.05 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.335 0.494 . . . . 72.53 112.335 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.16 -31.29 67.51 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.066 -0.515 . . . . 71.54 110.777 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -167.03 161.26 14.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.015 -0.539 . . . . 75.23 111.413 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.451 HG13 HG21 ' A' ' 61' ' ' ILE . 42.2 mt -122.83 116.71 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.356 -0.384 . . . . 74.3 111.174 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.2 m -124.35 171.32 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.903 0.383 . . . . 73.02 111.478 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.523 HD23 HG12 ' A' ' 76' ' ' VAL . 97.5 mt -75.62 145.34 41.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.479 -0.328 . . . . 63.51 110.809 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 m -65.8 148.66 51.42 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.663 0.268 . . . . 61.2 110.974 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 83.8 mt -64.66 0.76 1.01 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 112.728 0.64 . . . . 63.44 112.728 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 118.757 -0.64 . . . . 74.32 111.692 177.079 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.715 0.293 . . . . 62.24 111.112 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.49 ' N ' ' SD ' ' A' ' 2' ' ' MET . 1.1 mpt? -73.52 177.06 5.57 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.201 0.524 . . . . 65.52 111.313 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -93.46 89.32 6.26 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.198 0.523 . . . . 73.01 110.358 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.51 133.89 38.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.89 -0.595 . . . . 72.21 111.97 -176.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.553 ' HB3' ' HB2' ' A' ' 103' ' ' ASP . . . -84.36 95.5 8.76 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.943 0.402 . . . . 54.24 111.559 177.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -96.13 116.31 28.78 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.922 0.391 . . . . 74.4 111.443 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -152.55 62.82 0.38 Allowed Glycine 0 CA--C 1.527 0.836 0 CA-C-N 115.846 -0.615 . . . . 73.51 112.104 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 27.5 pt -62.6 128.61 24.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.302 0.572 . . . . 75.54 112.211 -177.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 12.7 p -141.25 160.33 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.166 -0.47 . . . . 71.43 111.315 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.511 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.2 pt? -116.8 -49.36 2.63 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.682 0.277 . . . . 73.23 111.162 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -86.2 122.16 29.81 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 110.002 -0.37 . . . . 65.53 110.002 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -152.14 126.59 9.38 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.285 0.564 . . . . 71.23 112.096 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -86.59 122.98 31.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.732 -0.667 . . . . 65.24 111.181 -178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.9 p -72.49 69.03 0.83 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.395 0.617 . . . . 63.22 111.522 176.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -80.63 -35.85 33.39 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.066 -0.515 . . . . 53.35 111.641 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -76.06 112.28 12.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.752 0.311 . . . . 72.12 111.188 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 170.08 19.5 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.777 -0.725 . . . . 74.1 112.124 173.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -45.14 108.28 0.12 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.342 0.497 . . . . 60.2 112.342 -176.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 92.1 mt -77.38 133.03 38.8 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.133 -0.485 . . . . 75.42 110.643 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.495 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 7.1 mtmp? -136.21 140.82 43.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.52 -0.309 . . . . 73.23 111.305 -176.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -65.4 135.48 55.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.095 0.406 . . . . 73.14 112.095 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.0 m -116.14 -63.96 1.38 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.835 0.35 . . . . 72.14 111.428 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.26 -173.68 4.15 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.043 0.449 . . . . 63.55 111.747 -178.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.6 tp -102.09 127.24 49.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.393 -0.367 . . . . 61.52 110.177 171.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.6 tpp180 -79.63 -68.47 0.66 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.969 0.414 . . . . 75.4 111.951 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -163.42 145.6 9.8 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.275 0.472 . . . . 71.55 112.275 -171.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -106.67 103.1 12.46 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.286 -0.416 . . . . 62.11 110.911 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 m -76.6 109.98 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-O 121.344 0.592 . . . . 63.32 111.172 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 70.0 mtp180 -92.67 170.43 9.72 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.2 -0.455 . . . . 70.25 111.957 -174.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 40' ' ' GLU . 48.6 mt -80.82 144.18 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.484 -0.325 . . . . 73.22 111.1 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -110.48 133.25 53.46 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.767 0.318 . . . . 64.45 111.028 176.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.6 m-20 -79.68 162.43 25.23 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.49 0.552 . . . . 74.03 112.49 -175.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.89 -38.71 67.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.73 -0.668 . . . . 65.31 110.869 174.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.25 -37.44 67.22 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.534 -0.757 . . . . 73.41 111.539 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.25 -32.18 4.99 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-N 116.061 -0.518 . . . . 60.31 111.952 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 54.8 m -62.7 166.54 5.33 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.055 0.455 . . . . 75.12 111.737 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.31 146.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.933 0.397 . . . . 73.14 111.507 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 32.7 t -94.65 156.62 16.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.093 0.473 . . . . 72.44 111.508 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.452 ' HA ' ' NH2' ' A' ' 29' ' ' ARG . 13.5 t70 -67.06 -31.56 72.15 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.177 -0.465 . . . . 64.14 111.043 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.439 ' HB2' HD12 ' A' ' 30' ' ' ILE . 16.9 mm-40 -73.45 152.53 40.73 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.434 0.635 . . . . 73.13 112.008 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 56.9 mt -114.56 147.17 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.972 -0.558 . . . . 53.33 111.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.57 -60.51 2.23 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.064 0.459 . . . . 72.52 111.411 176.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -147.04 167.44 24.06 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 116.105 -0.498 . . . . 73.35 111.019 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -128.93 118.21 22.26 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.243 -0.435 . . . . 73.04 110.739 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 42.2 m -95.76 124.97 40.02 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.385 0.513 . . . . 72.32 112.385 -175.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -106.4 167.87 9.54 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.086 0.47 . . . . 72.53 111.568 177.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -112.38 116.15 29.87 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.78 -0.646 . . . . 74.25 111.031 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.411 HD12 HG21 ' A' ' 59' ' ' VAL . 65.3 mt -121.6 121.06 36.57 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 73.21 111.238 178.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 56' ' ' MET . 20.2 ptmt -96.45 128.47 43.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.395 0.617 . . . . 62.35 111.603 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.9 t -88.63 150.37 23.06 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.175 0.512 . . . . 65.31 111.893 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -78.37 118.8 20.89 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.14 -0.482 . . . . 73.11 110.945 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 143.14 -77.84 0.28 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.335 -0.459 . . . . 61.4 112.393 -177.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -95.52 -5.66 42.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.046 0.387 . . . . 72.32 112.046 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.97 0.9 54.33 Favored Glycine 0 CA--C 1.532 1.11 0 N-CA-C 114.448 0.539 . . . . 51.42 114.448 175.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 -79.43 153.98 29.28 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 117.282 0.541 . . . . 72.15 111.582 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.484 ' HA ' ' HA ' ' A' ' 49' ' ' LYS . 22.8 ptp -105.45 144.11 32.68 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.903 -0.59 . . . . 63.5 111.441 176.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 100' ' ' ILE . 24.0 pt -106.06 144.62 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 116.103 -0.499 . . . . 62.14 110.598 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -87.74 105.43 17.38 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.836 0.35 . . . . 62.53 111.017 -178.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.47 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -101.1 119.62 49.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 N-CA-C 112.218 0.451 . . . . 74.32 112.218 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.538 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 39.2 m -106.79 129.13 54.7 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.989 0.423 . . . . 43.13 111.623 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.9 pt -126.7 149.85 69.52 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 116.508 -0.315 . . . . 64.41 110.645 174.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -55.69 141.82 83.54 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.486 2.124 . . . . 73.31 112.843 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.27 -18.13 34.74 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.59 0.589 . . . . 65.23 112.59 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 45.1 t -62.38 -27.95 69.43 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.851 0.358 . . . . 63.41 111.484 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.7 t -77.08 128.58 80.71 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 116.512 -0.313 . . . . 73.25 111.034 178.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 155.42 33.45 Favored 'Trans proline' 0 CA--C 1.544 1.008 0 C-N-CA 122.797 2.331 . . . . 62.43 113.667 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.52 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 26.7 tp -67.89 134.42 50.82 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.095 -0.502 . . . . 64.43 111.749 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.414 ' H ' HD12 ' A' ' 67' ' ' LEU . 61.1 mmtt -83.74 -70.99 0.53 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.844 0.683 . . . . 74.33 112.844 -175.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.52 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 50.6 mt-10 55.6 49.85 15.68 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 120.702 0.287 . . . . 71.43 111.608 -175.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -66.65 169.56 7.6 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.119 0.485 . . . . 75.23 112.072 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.541 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 3.9 m-20 -60.66 138.3 58.09 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.994 -0.548 . . . . 74.22 111.061 176.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -62.68 125.31 23.51 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 116.389 -0.369 . . . . 71.01 111.615 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 69.32 17.63 8.18 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.593 0.757 . . . . 70.21 112.914 -176.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.541 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -80.21 146.33 31.79 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.991 -0.443 . . . . 71.21 111.265 175.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.459 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 75.4 mtt180 -69.99 114.81 8.52 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.046 0.45 . . . . 74.43 111.681 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.554 HG12 HD23 ' A' ' 107' ' ' LEU . 27.4 m -126.93 140.42 49.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.075 -0.511 . . . . 74.33 111.146 178.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 108' ' ' THR . 11.7 pt-20 -121.66 155.9 34.16 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.242 0.544 . . . . 74.43 111.331 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.6 mt -98.86 122.14 41.72 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.373 0.509 . . . . 60.53 112.373 -174.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mm -72.5 108.53 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 115.956 -0.565 . . . . 74.11 110.331 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 55.57 67.02 3.27 Favored Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 112.817 0.673 . . . . 74.11 112.817 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.87 137.7 10.03 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.778 2.318 . . . . 63.24 113.633 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 101' ' ' LYS . 40.1 pt -120.59 141.95 38.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 121.029 0.442 . . . . 73.02 110.995 174.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.72 129.0 36.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.611 -0.268 . . . . 72.12 110.468 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.446 ' OD1' HG22 ' A' ' 86' ' ' VAL . 7.1 t0 -73.08 132.64 43.57 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.277 0.56 . . . . 74.22 111.998 -174.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 32.5 m -67.21 -42.5 84.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.797 -0.638 . . . . 62.25 112.411 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.446 HG22 ' OD1' ' A' ' 84' ' ' ASP . 16.6 m -60.24 -16.93 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 112.183 0.438 . . . . 73.34 112.183 -174.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -106.08 -56.66 2.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.961 0.41 . . . . 73.35 111.679 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.1 p -68.46 -15.46 63.56 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.773 0.657 . . . . 71.34 112.773 -175.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.43 9.62 35.6 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.896 0.379 . . . . 73.21 111.848 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.7 m -120.28 -32.86 4.03 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.173 0.511 . . . . 71.32 110.829 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.643 ' HB3' ' HB3' ' A' ' 94' ' ' ALA . 49.3 m-85 -93.32 113.8 26.07 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.079 -0.51 . . . . 75.42 111.477 177.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -61.72 96.67 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.554 -0.293 . . . . 72.42 111.767 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 53.5 32.26 45.43 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.416 -0.356 . . . . 33.1 113.793 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.643 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . . . -121.64 114.03 20.58 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.074 0.464 . . . . 54.03 111.954 -177.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -84.98 31.36 0.55 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.063 0.459 . . . . 61.34 111.725 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.51 HG23 ' HB1' ' A' ' 94' ' ' ALA . 59.4 t -63.42 99.55 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 112.419 0.525 . . . . 34.42 112.419 -174.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 54.74 33.94 20.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.224 0.535 . . . . 75.25 111.886 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.85 160.68 19.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.754 1.02 . . . . 75.45 113.754 -174.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -107.32 143.92 34.91 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.828 -1.078 . . . . 72.11 111.614 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.515 HD12 HD12 ' A' ' 57' ' ' ILE . 63.2 mt -131.87 131.68 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 115.976 -0.556 . . . . 72.44 110.315 176.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.538 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 32.9 mtmm -109.14 126.03 52.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.761 0.315 . . . . 75.1 111.228 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.76 162.95 16.88 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.5 0.556 . . . . 72.45 112.5 -173.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' A' ' 5' ' ' ALA . 32.1 t70 -73.27 -29.15 62.54 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.583 -0.735 . . . . 73.4 110.542 176.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -174.45 162.63 3.53 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.995 -0.548 . . . . 74.32 111.266 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 34.2 mt -118.98 119.92 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-N 116.44 -0.345 . . . . 71.53 110.665 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.72 174.13 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-O 120.905 0.384 . . . . 74.22 111.834 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.554 HD23 HG12 ' A' ' 76' ' ' VAL . 95.0 mt -77.53 132.29 38.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.66 -0.246 . . . . 70.4 111.023 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 87.6 m -55.78 141.41 38.62 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.108 0.41 . . . . 73.34 112.108 -177.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.65 85.65 0.11 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.09 0.471 . . . . 71.33 111.642 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-N 116.377 -0.374 . . . . 74.23 111.414 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.64 0.257 . . . . 71.43 111.416 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.423 ' N ' ' SD ' ' A' ' 2' ' ' MET . 1.3 mpt? -77.37 100.02 5.79 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.668 0.618 . . . . 74.23 112.668 -176.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -122.89 140.25 53.17 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.483 -0.326 . . . . 72.23 110.896 171.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.429 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.1 mm? -99.0 147.72 24.73 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.663 0.268 . . . . 75.23 110.838 178.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -94.92 119.3 33.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.778 0.323 . . . . 70.11 111.439 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -68.12 -39.46 82.74 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.854 0.359 . . . . 60.35 111.698 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 89.71 94.23 1.15 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.252 -0.499 . . . . 60.03 113.538 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.6 pt -97.56 167.89 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 120.973 0.416 . . . . 50.31 111.227 176.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.11 108.39 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.987 0.422 . . . . 73.12 111.262 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.808 HD13 ' HG2' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -145.61 171.26 14.96 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.194 -0.457 . . . . 72.31 111.937 -179.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -104.88 22.53 15.04 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.491 0.552 . . . . 73.32 112.491 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.808 ' HG2' HD13 ' A' ' 10' ' ' LEU . 13.6 ptmm? -62.43 -40.1 95.47 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.404 0.52 . . . . 65.11 112.404 -176.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -100.68 112.45 24.84 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.075 0.464 . . . . 74.43 111.588 -177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -84.99 -170.27 3.05 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.175 -0.466 . . . . 75.31 111.956 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -87.01 139.78 30.23 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.009 0.433 . . . . 73.52 112.113 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -97.46 163.78 12.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.274 -0.421 . . . . 70.14 111.201 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.85 -151.6 9.14 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.982 -0.627 . . . . 72.05 112.71 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HG2' ' HG3' ' A' ' 51' ' ' LYS . 11.6 pt-20 -62.73 109.04 1.29 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.41 0.624 . . . . 74.33 111.255 178.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.8 mt -80.37 119.16 22.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.435 . . . . 71.35 110.189 175.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 73' ' ' ASN . 9.0 mtpm? -101.63 120.88 41.02 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.129 0.49 . . . . 71.35 111.729 -178.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.482 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 35.7 t80 -59.34 115.21 3.09 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.454 -0.793 . . . . 72.3 110.371 173.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.479 ' OG ' ' HG2' ' A' ' 49' ' ' LYS . 49.7 m -98.69 -64.42 1.04 Allowed 'General case' 0 N--CA 1.474 0.735 0 O-C-N 122.12 -0.362 . . . . 65.34 111.958 -178.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.28 176.96 11.12 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.287 0.565 . . . . 52.52 112.257 -178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.3 tp -91.25 107.32 19.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.809 -0.632 . . . . 70.02 110.513 175.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -61.66 -59.2 5.55 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.43 -0.35 . . . . 73.54 111.7 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -173.26 130.51 0.47 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.508 0.559 . . . . 74.41 112.508 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -98.58 99.54 10.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.99 -0.55 . . . . 73.42 110.102 171.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.8 m -77.71 115.54 19.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.027 0.442 . . . . 61.5 111.285 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.565 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 78.8 mtt85 -87.29 168.45 13.18 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.265 0.555 . . . . 73.22 112.153 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.3 mt -79.4 122.15 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 60.2 111.786 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.456 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.6 tt0 -91.94 112.59 24.58 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 120.9 0.381 . . . . 71.12 111.035 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -59.17 162.88 4.1 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.64 0.608 . . . . 65.12 112.64 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.35 -32.7 57.46 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 116.171 -0.468 . . . . 65.31 111.345 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.14 -7.26 22.05 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.493 0.553 . . . . 54.3 112.493 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 93.33 -10.28 73.42 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.234 -0.508 . . . . 73.24 113.27 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -93.4 145.41 24.5 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.39 -0.476 . . . . 40.44 111.518 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.456 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 28.9 t -75.49 151.72 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 116.525 -0.307 . . . . 74.54 111.521 -178.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.6 t -105.1 170.99 7.56 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.09 0.471 . . . . 72.4 111.679 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -71.26 -28.25 64.02 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.993 -0.549 . . . . 71.44 110.945 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -74.96 146.15 41.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.313 0.577 . . . . 71.12 112.225 -177.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 51.3 mt -99.0 153.63 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 115.655 -0.702 . . . . 74.54 111.348 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 24.0 tptm -108.83 -58.64 1.99 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.859 0.362 . . . . 70.34 111.359 179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.6 mt-10 -136.33 139.97 42.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.057 0.456 . . . . 72.53 111.286 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -107.53 112.43 25.19 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 116.347 -0.388 . . . . 74.31 111.203 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.6 m -103.64 122.23 44.58 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.702 0.63 . . . . 72.23 112.702 -177.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -105.83 161.16 14.67 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.341 0.656 . . . . 73.22 111.574 175.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -108.41 116.23 31.58 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.321 -0.4 . . . . 74.43 110.899 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.644 HD12 HG21 ' A' ' 59' ' ' VAL . 65.5 mt -113.12 144.4 42.7 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.699 0.285 . . . . 53.31 110.747 176.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG2' ' OG ' ' A' ' 22' ' ' SER . 14.7 mmmm -102.4 126.13 49.33 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.779 0.324 . . . . 72.42 111.314 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m -81.75 121.68 26.71 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 55.04 111.608 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.502 ' HG3' ' HG2' ' A' ' 18' ' ' GLU . 14.6 tmtt? -54.04 146.4 14.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.758 0.423 . . . . 73.51 112.024 179.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.58 -51.56 4.59 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.231 -0.509 . . . . 71.3 113.343 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -85.86 -31.79 22.05 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 120.876 0.37 . . . . 75.43 111.337 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 61.3 34.53 88.54 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 121.431 -0.414 . . . . 52.5 113.308 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -104.42 152.55 22.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.547 -0.384 . . . . 74.41 111.099 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.9 ptp -95.11 114.18 25.95 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 121.121 0.486 . . . . 70.2 112.218 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 100' ' ' ILE . 28.9 pt -99.01 135.67 33.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.307 -0.406 . . . . 71.32 110.654 175.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 2.0 mp0 -87.05 104.28 16.17 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.933 0.397 . . . . 71.44 110.637 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 48' ' ' LEU . 91.9 t -94.94 114.23 31.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.954 0.407 . . . . 73.55 111.423 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.483 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 29.5 t -107.52 131.49 54.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.098 0.475 . . . . 75.11 111.693 -176.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 18.9 pt -123.51 147.86 54.02 Favored Pre-proline 0 CA--C 1.54 0.592 0 CA-C-N 115.947 -0.57 . . . . 61.52 111.313 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -53.27 151.4 22.63 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.999 2.466 . . . . 73.24 113.911 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.02 -47.65 61.61 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.664 0.987 . . . . 75.11 113.664 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.5 m -70.49 -4.12 21.22 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.906 0.706 . . . . 63.33 112.906 -174.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.25 119.84 77.71 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 120.581 0.229 . . . . 75.33 110.496 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.18 142.94 44.02 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.942 2.428 . . . . 45.15 113.693 -176.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.99 128.58 36.18 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.041 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -79.35 -63.7 1.36 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.407 0.521 . . . . 72.01 112.407 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 58.64 48.97 10.95 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 112.625 0.602 . . . . 72.51 112.625 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -75.99 -166.01 0.54 Allowed 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.054 0.454 . . . . 75.23 112.071 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -91.48 158.74 16.31 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.406 0.521 . . . . 73.34 112.406 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.6 t80 -60.12 -22.1 62.4 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.891 0.701 . . . . 74.22 112.891 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.427 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 15.3 m120 -114.54 20.88 15.02 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.883 -0.511 . . . . 62.5 111.308 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.63 117.61 20.7 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 120.865 0.364 . . . . 53.24 111.734 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.612 ' NH2' ' HG3' ' A' ' 110' ' ' GLU . 49.9 mtp180 -73.53 111.28 8.52 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.282 -0.417 . . . . 73.45 111.008 177.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.558 HG12 HD23 ' A' ' 107' ' ' LEU . 34.6 m -117.41 159.32 17.63 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.286 0.565 . . . . 34.1 112.401 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -135.85 152.55 51.17 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.217 -0.447 . . . . 45.23 110.979 173.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.5 mt -100.73 138.54 37.64 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.552 0.575 . . . . 61.21 112.552 -173.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.427 HG22 HD22 ' A' ' 80' ' ' ASN . 49.4 mm -86.21 111.54 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.883 -0.598 . . . . 75.14 110.698 176.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.427 HD22 HG22 ' A' ' 79' ' ' ILE . 42.0 m-80 47.04 70.26 2.19 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.958 0.725 . . . . 54.01 112.958 -177.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.33 151.95 17.91 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.982 2.455 . . . . 63.44 113.668 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 pt -141.1 139.99 32.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-N 116.22 -0.446 . . . . 73.42 111.054 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -89.24 102.71 15.37 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.675 0.274 . . . . 73.24 111.021 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.14 166.57 23.28 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.006 0.431 . . . . 75.34 111.54 -174.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.8 t -126.52 -4.26 6.61 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.734 0.642 . . . . 53.43 112.734 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 m -54.11 -21.81 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.945 0.72 . . . . 74.14 112.945 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.35 -47.85 69.21 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.911 0.386 . . . . 75.3 111.287 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.2 p -74.26 -10.63 59.79 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.8 0.296 . . . . 55.24 111.8 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.01 -38.96 72.65 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.862 0.363 . . . . 64.03 111.314 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 43.8 p -83.69 -42.94 16.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.241 0.543 . . . . 74.11 110.79 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -64.91 158.86 24.15 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.437 0.637 . . . . 73.52 111.847 176.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 92' ' ' GLN . 17.3 tt0 -88.19 21.14 2.9 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.388 0.613 . . . . 61.32 110.075 174.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 73.29 31.24 61.54 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.348 -0.453 . . . . 75.34 112.495 -172.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.31 -51.66 5.32 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.526 0.565 . . . . 53.24 112.526 -175.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -114.8 161.58 18.01 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.852 0.358 . . . . 64.11 111.607 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 28.2 m -120.01 26.76 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 113.224 0.824 . . . . 73.34 113.224 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.02 96.25 0.31 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 109.304 -0.628 . . . . 71.34 109.304 170.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -121.52 159.45 26.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.787 1.032 . . . . 74.35 113.787 -165.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 34.7 m-85 -115.65 129.11 56.37 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.726 -1.124 . . . . 75.02 112.793 -174.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 HD12 ' A' ' 57' ' ' ILE . 55.7 mt -104.14 108.02 23.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.998 -0.546 . . . . 75.53 109.728 169.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.483 ' HG2' ' HB3' ' A' ' 60' ' ' SER . 52.0 mtpt -93.48 138.49 31.72 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.501 -0.318 . . . . 73.01 111.464 -174.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.31 171.86 13.86 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.546 0.572 . . . . 62.44 112.546 -175.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 -42.55 40.71 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.712 -0.676 . . . . 64.33 111.252 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -163.95 158.62 19.89 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.164 -0.471 . . . . 74.31 111.07 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.538 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 42.1 mt -116.57 115.84 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 116.53 -0.305 . . . . 65.5 110.936 -179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.91 179.08 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 120.838 0.351 . . . . 62.02 111.314 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.558 HD23 HG12 ' A' ' 76' ' ' VAL . 97.9 mt -86.31 142.21 28.68 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.687 0.28 . . . . 74.23 110.889 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.725 HG22 ' HG2' ' A' ' 110' ' ' GLU . 1.8 m -68.26 120.26 14.13 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.918 0.389 . . . . 74.41 110.975 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 75.0 mt -81.94 34.16 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.218 0.821 . . . . 63.51 113.218 -171.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.725 ' HG2' HG22 ' A' ' 108' ' ' THR . 6.3 pt-20 . . . . . 0 C--O 1.256 1.442 0 CA-C-O 119.491 -0.29 . . . . 72.45 111.386 175.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.5 mtm . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.439 0.162 . . . . 61.3 111.071 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -128.14 112.75 14.9 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.224 0.535 . . . . 74.54 110.841 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.424 ' HD3' HH11 ' A' ' 3' ' ' ARG . 37.5 ttp180 -91.6 88.7 6.85 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 73.1 110.921 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -152.35 164.71 36.91 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.796 -0.638 . . . . 75.22 111.189 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -168.98 114.69 0.59 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.992 0.367 . . . . 74.51 111.992 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -150.56 157.27 42.8 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.185 0.517 . . . . 44.23 111.632 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -136.51 -26.74 0.41 Allowed Glycine 0 CA--C 1.527 0.834 0 CA-C-N 116.171 -0.468 . . . . 63.31 112.682 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.9 pt -87.04 170.55 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-O 120.952 0.406 . . . . 75.14 111.303 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.2 t -90.28 89.21 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.161 0.505 . . . . 71.01 110.356 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.58 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.8 OUTLIER -79.22 -24.3 43.19 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.324 -0.398 . . . . 74.33 111.878 -177.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -93.9 -169.17 2.03 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 122.288 -0.258 . . . . 54.31 111.069 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -109.53 -36.06 6.07 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.612 0.967 . . . . 52.43 113.612 -173.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.7 95.8 0.11 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.324 0.583 . . . . 75.13 111.849 -177.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 51.2 p -87.99 12.48 13.24 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.91 -0.587 . . . . 61.33 111.969 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.1 m -67.88 140.28 56.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.876 0.37 . . . . 73.14 111.251 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.461 ' HD1' HE21 ' A' ' 53' ' ' GLN . 17.1 m-85 -76.61 27.08 0.13 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 120.794 0.33 . . . . 73.42 111.848 -175.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.2 -112.5 3.59 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 121.218 -0.515 . . . . 74.41 112.266 -174.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -104.35 131.72 51.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.955 0.407 . . . . 64.32 110.994 176.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.1 mt -92.98 128.35 38.82 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.608 -0.515 . . . . 65.43 109.608 174.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 mtpt -101.66 115.71 31.12 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.155 0.503 . . . . 75.23 110.802 -174.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.441 ' HA ' ' CD2' ' A' ' 48' ' ' LEU . 51.6 t80 -60.17 143.77 51.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.408 -0.814 . . . . 74.04 112.536 -174.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.542 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 34.3 t -121.3 -66.39 1.05 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.851 0.315 . . . . 62.3 111.851 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.91 178.01 9.29 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.027 0.441 . . . . 53.4 112.181 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 67' ' ' LEU . 58.6 tp -94.6 107.46 19.45 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.795 -0.446 . . . . 60.44 109.795 170.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 25' ' ' ARG . 15.7 tpt180 -65.23 -60.29 3.15 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.277 0.473 . . . . 71.43 112.277 -173.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -165.86 138.08 4.01 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.161 0.43 . . . . 74.24 112.161 -175.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 44' ' ' ARG . 39.2 mt-10 -96.51 101.83 13.52 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.284 -0.416 . . . . 71.11 110.079 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.3 m -69.83 125.92 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.118 0.485 . . . . 72.32 111.234 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.444 ' HG2' HG12 ' A' ' 41' ' ' ILE . 65.2 mtt85 -104.88 151.97 23.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.433 0.635 . . . . 71.13 112.373 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.3 mt -66.81 122.03 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.083 -0.962 . . . . 62.0 112.438 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -99.27 132.82 44.33 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.425 -0.352 . . . . 72.34 111.048 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 -86.11 169.66 12.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.498 0.555 . . . . 72.14 112.498 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 33' ' ' GLU . 2.4 mp0 -59.12 -35.79 74.06 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.559 -0.746 . . . . 62.51 111.499 -179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -60.49 -28.46 68.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.104 -0.498 . . . . 64.52 112.015 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 113.73 -29.67 7.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 121.177 -0.535 . . . . 33.43 112.368 -174.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.9 m -65.18 143.29 57.95 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.07 0.462 . . . . 64.02 111.62 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.79 135.48 35.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.057 0.456 . . . . 75.01 111.763 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.3 t -82.53 158.08 23.28 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.828 -0.624 . . . . 43.21 111.506 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -74.43 -8.13 55.26 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.135 0.493 . . . . 62.44 110.835 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.09 132.45 43.32 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.865 -0.607 . . . . 53.5 110.893 175.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 ' HG2' ' A' ' 29' ' ' ARG . 52.7 mt -97.99 148.6 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-O 120.835 0.35 . . . . 74.15 111.497 -175.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -102.73 -57.44 2.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.75 0.309 . . . . 71.44 111.068 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.02 151.97 44.5 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.884 0.373 . . . . 74.35 111.218 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 27' ' ' GLU . 1.7 ptp180 -116.67 117.14 28.98 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.231 0.539 . . . . 64.34 111.27 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.1 m -91.48 123.52 34.96 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 73.14 112.584 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.502 ' OH ' HD12 ' A' ' 67' ' ' LEU . 54.5 m-85 -104.36 148.03 26.86 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.036 0.534 . . . . 74.24 110.943 174.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -94.5 120.9 35.44 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.839 0.352 . . . . 75.54 110.867 174.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 59' ' ' VAL . 63.4 mt -123.55 145.72 48.66 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.708 0.289 . . . . 71.34 110.821 177.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HE2' ' HB2' ' A' ' 22' ' ' SER . 0.0 OUTLIER -112.3 141.64 45.78 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 120.989 0.424 . . . . 65.15 111.007 174.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 92.1 p -106.87 155.44 19.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 73.23 111.822 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -90.94 157.23 17.43 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.91 0.386 . . . . 74.44 111.318 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.32 -61.46 3.86 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.979 -0.629 . . . . 70.31 112.031 -176.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.461 HE21 ' HD1' ' A' ' 16' ' ' PHE . 2.8 mp0 -71.3 -24.34 62.12 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.367 0.267 . . . . 74.14 110.847 173.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.76 42.51 45.91 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 116.042 -0.526 . . . . 50.53 114.249 173.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -138.91 168.47 19.75 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.911 0.386 . . . . 75.12 111.543 -175.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptm -95.39 148.26 22.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.516 0.675 . . . . 74.2 111.892 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 100' ' ' ILE . 22.5 pt -130.78 150.88 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 115.414 -0.812 . . . . 72.53 109.759 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.675 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -107.01 105.35 15.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.205 -0.998 . . . . 71.35 111.32 177.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.606 HG21 HD12 ' A' ' 48' ' ' LEU . 84.7 t -94.72 121.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.307 -0.406 . . . . 75.54 111.303 -177.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' ' HG2' ' A' ' 101' ' ' LYS . 91.3 p -113.63 131.75 56.02 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.418 0.628 . . . . 72.05 111.503 -178.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.9 pt -122.86 145.4 45.43 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.724 -0.671 . . . . 72.11 110.302 175.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.82 147.74 17.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.45 2.1 . . . . 61.15 113.231 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.2 -22.71 63.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.882 0.372 . . . . 61.21 111.701 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 57.5 p -65.51 -21.38 66.61 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.305 -0.407 . . . . 70.32 111.742 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.3 t -85.54 124.5 71.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-N 116.562 -0.29 . . . . 74.43 110.939 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.92 159.45 7.22 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.161 2.574 . . . . 55.03 114.617 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 45.2 tp -75.4 128.42 35.33 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.981 -0.554 . . . . 64.03 111.186 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 4.5 mptp? -83.92 -64.26 1.2 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.942 0.719 . . . . 74.01 112.942 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.534 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.7 mt-10 57.02 52.66 8.9 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.843 0.683 . . . . 72.41 112.843 -178.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.48 173.0 9.45 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.006 -0.434 . . . . 72.2 111.464 173.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.16 160.57 31.85 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 120.974 0.416 . . . . 74.44 111.845 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -71.2 134.46 46.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.941 -0.392 . . . . 73.41 109.941 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 68.52 12.66 8.78 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.983 0.513 . . . . 75.35 112.153 -175.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.49 136.96 54.0 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.88 0.372 . . . . 54.4 111.576 178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -78.27 104.59 8.95 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.439 -0.346 . . . . 74.31 110.873 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.527 HG12 HD23 ' A' ' 107' ' ' LEU . 32.5 m -124.62 154.62 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 121.311 0.577 . . . . 55.35 111.955 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -130.01 155.69 45.7 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.26 0.552 . . . . 73.22 110.866 176.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.2 mt -103.04 139.28 38.79 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.529 0.68 . . . . 63.44 112.421 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.466 HG22 HD22 ' A' ' 80' ' ' ASN . 45.6 mm -85.06 106.66 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.581 -0.736 . . . . 65.44 110.518 175.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.466 HD22 HG22 ' A' ' 79' ' ' ILE . 51.3 m-80 54.6 68.57 2.57 Favored Pre-proline 0 N--CA 1.479 1.004 0 N-CA-C 112.335 0.494 . . . . 71.3 112.335 -176.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.04 130.8 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.724 2.282 . . . . 63.11 113.452 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 pt -124.91 142.97 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.734 0.302 . . . . 74.22 111.317 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.66 115.78 26.44 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.6 0.238 . . . . 73.21 110.914 176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.13 165.16 25.66 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.168 0.509 . . . . 71.43 111.226 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.0 m -150.27 -37.17 0.15 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.953 0.406 . . . . 41.11 111.265 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.76 6.32 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 112.787 0.662 . . . . 64.33 112.787 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -48.53 -48.24 38.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.399 0.518 . . . . 74.45 112.399 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.8 t -59.34 -15.61 17.4 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.618 0.599 . . . . 55.42 112.618 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -109.22 -21.05 12.74 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.569 0.581 . . . . 72.4 112.569 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 60.0 p -98.36 -43.1 7.06 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.572 0.582 . . . . 74.41 112.572 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -78.81 -80.67 0.11 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.765 0.284 . . . . 71.14 111.765 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -142.89 -49.03 0.33 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.339 0.496 . . . . 70.2 112.339 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 153.82 -32.22 0.74 Allowed Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.274 -0.965 . . . . 71.22 113.854 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.59 10.48 9.02 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 122.42 -0.459 . . . . 64.22 111.718 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -96.79 94.41 7.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.009 -0.542 . . . . 70.41 111.112 -177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.48 -33.27 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 112.826 0.676 . . . . 74.35 112.826 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.34 130.13 45.41 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.734 0.302 . . . . 64.1 110.28 175.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.548 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -62.77 108.36 1.16 Allowed 'General case' 0 C--O 1.259 1.562 0 CA-C-O 122.84 1.305 . . . . 74.34 114.275 -165.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.675 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 80.1 m-85 -84.86 112.81 20.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 113.377 -1.738 . . . . 75.03 110.418 169.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.577 HD12 HD12 ' A' ' 57' ' ' ILE . 30.4 mt -90.43 104.34 15.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.3 0.571 . . . . 62.51 109.698 177.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.549 ' HG2' ' OG ' ' A' ' 60' ' ' SER . 96.5 mttt -85.21 131.5 34.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 55.41 111.618 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.93 155.62 45.76 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.177 0.513 . . . . 73.5 112.194 -177.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -68.83 -39.14 80.14 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 115.753 -0.658 . . . . 65.13 110.94 176.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -164.31 162.09 22.19 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.029 -0.532 . . . . 74.1 111.422 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.47 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 39.9 mt -118.75 115.93 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.363 -0.38 . . . . 74.22 111.077 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.0 m -125.01 170.52 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-O 120.743 0.306 . . . . 73.21 111.682 -178.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.527 HD23 HG12 ' A' ' 76' ' ' VAL . 95.2 mt -72.15 139.09 48.12 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 75.31 110.921 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -57.79 125.08 21.47 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.605 -0.271 . . . . 50.55 111.722 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 80.6 mt -58.12 92.47 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.897 0.38 . . . . 45.22 110.013 174.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 C--O 1.253 1.282 0 CA-C-O 118.363 -0.827 . . . . 74.04 112.599 -175.616 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.769 0.319 . . . . 65.54 111.369 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 62.1 mtt -86.7 164.56 16.69 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.123 0.487 . . . . 64.21 111.331 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.452 ' HA ' ' NE ' ' A' ' 3' ' ' ARG . 6.1 mmp_? -106.5 162.9 13.32 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.022 0.439 . . . . 71.22 110.271 169.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.458 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.2 mm? -94.8 122.48 37.46 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.248 0.547 . . . . 71.12 111.431 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.51 147.45 39.77 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.8 0.667 . . . . 43.41 112.8 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -85.3 24.61 1.11 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.702 -0.681 . . . . 74.21 111.662 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -63.83 -37.72 95.08 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.557 -0.354 . . . . 51.51 113.334 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.24 140.68 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.194 0.521 . . . . 55.2 111.287 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -97.72 114.89 36.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.261 -0.427 . . . . 75.12 111.225 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 pp -120.54 173.71 7.01 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.061 0.457 . . . . 64.14 111.515 178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -111.4 -92.81 0.46 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 122.269 -0.269 . . . . 73.22 110.644 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? 177.39 98.68 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.76 -0.83 . . . . 64.41 108.76 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -58.51 101.35 0.08 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.175 0.806 . . . . 74.31 113.175 -172.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.1 t -62.11 -17.01 56.42 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.874 -0.603 . . . . 44.14 111.07 172.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.497 ' O ' ' HA3' ' A' ' 52' ' ' GLY . 86.7 m -64.77 -22.29 66.95 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.858 -0.61 . . . . 40.34 110.928 173.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -123.51 91.71 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.336 -0.393 . . . . 72.2 112.058 -179.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.73 -178.93 8.31 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 120.667 -0.778 . . . . 54.12 111.578 168.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' H ' ' HG3' ' A' ' 18' ' ' GLU . 1.3 pp20? -54.34 137.77 41.01 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.11 0.955 . . . . 62.15 112.161 -177.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 70.0 mt -86.13 170.94 11.73 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.62 -0.718 . . . . 70.23 111.278 -175.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.721 ' HG2' ' HA ' ' A' ' 73' ' ' ASN . 0.2 OUTLIER -158.49 133.31 8.31 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.002 0.43 . . . . 74.43 111.894 -179.606 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.465 ' HA ' HD22 ' A' ' 48' ' ' LEU . 36.1 t80 -72.74 143.99 47.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.118 -0.492 . . . . 75.35 111.566 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 t -125.03 -65.39 1.03 Allowed 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.348 -0.22 . . . . 62.45 111.413 174.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.16 -173.84 4.06 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.916 0.388 . . . . 64.31 112.039 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.4 tp -94.94 133.08 39.08 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 120.806 0.336 . . . . 74.45 111.134 174.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -88.29 -65.06 1.06 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.837 0.351 . . . . 75.04 111.836 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -164.32 142.93 7.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.846 0.355 . . . . 70.12 111.698 -176.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -106.59 98.98 8.59 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.871 -0.418 . . . . 75.32 109.871 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.444 ' O ' HG23 ' A' ' 28' ' ' VAL . 28.8 m -71.8 92.3 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 121.864 0.84 . . . . 73.12 111.352 -176.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.652 ' HG2' HG12 ' A' ' 41' ' ' ILE . 71.5 mtt180 -83.34 159.45 21.86 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.583 -0.735 . . . . 74.42 112.344 -177.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 58.9 mt -81.01 132.93 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.56 -0.745 . . . . 74.41 110.911 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -110.57 128.17 55.54 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.837 0.351 . . . . 75.14 110.536 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -67.79 153.39 43.82 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.638 0.606 . . . . 72.42 112.638 -173.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -52.95 -36.94 60.58 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.281 0.563 . . . . 55.25 110.742 172.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -51.05 -42.65 60.66 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.377 -0.829 . . . . 61.15 111.617 175.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.95 -39.98 1.64 Allowed Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.367 -0.444 . . . . 64.12 112.55 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.5 m -68.98 148.27 50.38 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.183 0.516 . . . . 73.34 111.938 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.64 137.73 20.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.081 -0.509 . . . . 64.12 111.673 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.7 t -88.6 166.92 13.8 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 121.108 0.48 . . . . 72.15 111.727 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -87.81 -7.62 57.03 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.359 -0.382 . . . . 64.21 110.95 173.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.18 135.74 46.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.912 0.387 . . . . 74.23 110.318 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.652 HG12 ' HG2' ' A' ' 29' ' ' ARG . 39.1 mt -111.48 157.75 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-O 121.158 0.504 . . . . 70.21 111.564 -173.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -97.32 -55.1 2.94 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.073 0.463 . . . . 65.21 110.387 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.419 ' H ' HG23 ' A' ' 28' ' ' VAL . 33.3 mt-10 -143.9 155.35 44.05 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.989 -0.55 . . . . 71.25 111.348 175.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.439 ' O ' HG12 ' A' ' 61' ' ' ILE . 39.7 ttm180 -115.99 110.65 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.985 0.421 . . . . 73.34 110.241 175.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' VAL . 90.9 m -94.98 125.55 39.72 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.292 0.479 . . . . 73.34 112.292 -175.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -108.06 158.08 17.71 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.26 0.553 . . . . 73.42 112.371 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -96.55 107.21 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.539 -0.755 . . . . 75.42 110.659 174.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.775 HD12 HG21 ' A' ' 59' ' ' VAL . 56.6 mt -120.43 160.56 22.86 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.204 0.526 . . . . 65.21 111.433 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -115.45 145.6 42.43 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.235 -0.438 . . . . 75.13 110.871 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.1 m -128.73 123.66 33.6 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 122.216 -0.303 . . . . 45.24 111.759 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -64.36 -31.72 73.04 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.618 0.599 . . . . 71.11 112.618 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.497 ' HA3' ' O ' ' A' ' 15' ' ' THR . . . -50.32 -75.67 0.2 Allowed Glycine 0 CA--C 1.525 0.661 0 C-N-CA 121.09 -0.576 . . . . 72.55 113.406 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -86.74 7.42 26.86 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 122.455 -0.438 . . . . 71.44 111.63 177.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 55.43 36.78 64.29 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 114.486 0.554 . . . . 74.14 114.486 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -133.28 -179.72 5.68 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.071 0.462 . . . . 65.35 111.407 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.87 149.19 22.75 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.115 0.483 . . . . 74.34 111.134 176.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.573 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 31.2 pt -124.46 136.3 61.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 72.35 110.668 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.768 ' HA ' HE21 ' A' ' 58' ' ' GLN . 0.0 OUTLIER -94.58 104.41 16.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.428 -0.509 . . . . 62.51 110.461 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.775 HG21 HD12 ' A' ' 48' ' ' LEU . 95.6 t -95.01 117.05 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 N-CA-C 111.937 0.347 . . . . 74.24 111.937 -174.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.7 m -106.97 116.55 32.11 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.381 -0.372 . . . . 53.03 111.191 -179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.478 HG21 HG13 ' A' ' 105' ' ' ILE . 21.8 pt -110.16 148.9 39.29 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 116.186 -0.461 . . . . 73.33 111.126 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.34 153.85 56.98 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.517 2.145 . . . . 51.52 113.195 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.42 -19.19 64.48 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.55 0.574 . . . . 34.41 112.55 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.8 m -68.35 -9.33 47.3 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.686 0.279 . . . . 70.54 111.689 177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.456 HG11 HD12 ' A' ' 61' ' ' ILE . 45.5 t -92.8 132.14 31.96 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 116.481 -0.327 . . . . 64.43 111.501 179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -177.09 1.9 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.594 2.196 . . . . 73.42 113.778 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' A' ' 69' ' ' GLU . 30.9 tp -82.67 141.68 32.27 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.088 -0.506 . . . . 75.11 111.806 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.405 ' HE2' HG12 ' A' ' 65' ' ' VAL . 4.7 mptp? -102.4 -68.2 0.84 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.858 0.361 . . . . 75.24 111.643 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 38.1 mm-40 50.75 56.12 8.48 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.668 0.618 . . . . 75.42 112.668 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -75.73 171.49 14.27 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.0 0.429 . . . . 71.13 111.189 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -71.52 151.46 43.87 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 75.1 112.305 -179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.409 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 82.0 t80 -56.98 121.85 10.91 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.726 -0.67 . . . . 65.02 110.798 174.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.721 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.9 OUTLIER 72.09 30.39 2.16 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.678 0.622 . . . . 74.12 112.678 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -84.25 145.1 28.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.535 -0.302 . . . . 62.11 110.512 168.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 mtt85 -74.46 114.99 13.48 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.165 -0.335 . . . . 72.13 111.458 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.512 HG12 HD23 ' A' ' 107' ' ' LEU . 31.0 m -125.5 147.24 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 120.671 0.272 . . . . 62.21 111.599 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.38 149.59 50.47 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.876 0.369 . . . . 71.0 110.789 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.415 ' CD2' HG12 ' A' ' 105' ' ' ILE . 98.1 mt -102.16 137.18 40.76 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.591 0.589 . . . . 53.45 112.591 -172.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.8 mm -83.68 106.67 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.909 -0.587 . . . . 71.35 110.515 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.443 HD22 ' N ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER 62.09 64.35 1.86 Allowed Pre-proline 0 N--CA 1.476 0.862 0 CA-C-N 116.268 -0.424 . . . . 72.4 112.138 -178.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.98 128.86 6.7 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.62 2.214 . . . . 62.24 112.979 177.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.6 pt -135.06 127.48 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.962 0.41 . . . . 75.31 111.565 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.12 99.69 3.44 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.875 -0.417 . . . . 75.02 109.875 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -69.36 159.65 32.76 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.298 0.57 . . . . 73.11 112.24 -171.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.1 m -136.17 -10.72 1.97 Allowed 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.907 -0.588 . . . . 70.52 111.92 -175.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.7 m -116.06 2.77 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 N-CA-C 112.621 0.6 . . . . 71.43 112.621 -174.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.442 ' O ' HG22 ' A' ' 90' ' ' THR . . . -63.55 78.82 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.103 0.478 . . . . 71.2 111.985 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.7 p -59.46 -25.9 64.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.301 -0.409 . . . . 44.23 111.936 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.77 58.88 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.505 0.557 . . . . 74.32 112.505 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 95' ' ' ASP . 11.5 t -93.73 -40.62 10.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 120.903 0.382 . . . . 74.32 111.775 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -65.81 -31.48 72.47 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.794 0.331 . . . . 64.24 111.644 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -62.5 -25.97 68.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.007 0.432 . . . . 65.24 110.759 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -97.72 13.85 63.55 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 116.091 -0.504 . . . . 50.34 112.929 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 61.45 25.45 15.39 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.41 0.522 . . . . 43.43 112.41 179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.492 ' HB3' ' OG1' ' A' ' 90' ' ' THR . 9.9 t70 -97.81 114.28 26.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.015 0.436 . . . . 65.14 110.172 178.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 96' ' ' VAL . 16.3 t -104.88 -6.73 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 113.058 0.762 . . . . 73.23 113.058 -169.255 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -62.44 121.98 14.59 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.019 0.437 . . . . 53.01 110.632 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.573 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -59.75 123.3 16.51 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 113.998 1.11 . . . . 73.34 113.998 -171.506 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 70.6 m-85 -97.2 117.37 31.26 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.552 -1.204 . . . . 72.0 111.026 175.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 28.6 mt -95.92 105.47 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 121.18 0.514 . . . . 73.34 110.194 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -78.66 136.16 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.171 -0.468 . . . . 52.34 111.306 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.38 155.53 47.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.387 -0.37 . . . . 74.44 110.657 179.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -80.82 -23.64 39.06 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.55 0.214 . . . . 71.24 111.333 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -169.89 159.54 7.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.276 0.56 . . . . 63.0 111.741 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.478 HG13 HG21 ' A' ' 61' ' ' ILE . 37.0 mt -119.57 109.07 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.844 -0.616 . . . . 71.43 111.223 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.0 m -113.16 178.63 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 120.834 0.35 . . . . 72.35 111.084 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.512 HD23 HG12 ' A' ' 76' ' ' VAL . 96.1 mt -88.04 151.33 22.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.19 0.519 . . . . 75.21 111.331 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.548 HG22 ' HG ' ' A' ' 109' ' ' LEU . 16.8 m -87.03 134.9 33.45 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 110.138 -0.319 . . . . 73.53 110.138 176.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.548 ' HG ' HG22 ' A' ' 108' ' ' THR . 81.9 mt 65.75 20.59 11.5 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.274 0.472 . . . . 51.35 112.274 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.494 ' HB3' ' HB2' ' A' ' 107' ' ' LEU . 7.0 pt-20 . . . . . 0 C--O 1.251 1.173 0 N-CA-C 112.315 0.487 . . . . 74.52 112.315 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.7 ttm . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.668 0.27 . . . . 73.31 111.244 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 6' ' ' ASN . 64.0 mtt -131.5 136.22 47.72 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.619 0.247 . . . . 62.01 110.735 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 70.1 mtm180 -59.75 -14.56 14.99 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.019 0.438 . . . . 74.11 111.133 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.425 HD22 ' N ' ' A' ' 4' ' ' LEU . 2.9 mm? -69.73 114.89 8.36 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.073 -0.512 . . . . 70.24 110.541 174.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 4' ' ' LEU . . . 74.96 -42.04 0.48 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.902 0.705 . . . . 73.44 112.902 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 2' ' ' MET . 14.1 m120 -75.86 90.67 2.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.012 0.434 . . . . 64.44 111.706 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -129.47 -55.15 0.1 Allowed Glycine 0 CA--C 1.527 0.784 0 C-N-CA 121.478 -0.391 . . . . 63.51 112.76 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 37.7 pt -59.96 149.15 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 120.836 0.35 . . . . 74.35 111.925 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.8 t -70.1 130.43 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 120.824 0.345 . . . . 61.54 111.346 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.36 178.56 7.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.154 0.502 . . . . 74.43 112.142 -176.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -66.22 171.41 4.75 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.898 -0.592 . . . . 54.52 112.596 -177.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.444 ' NZ ' ' HB2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -174.45 142.69 0.78 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.169 -0.468 . . . . 73.54 110.943 174.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -66.9 105.15 1.53 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.957 0.408 . . . . 61.11 111.72 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.6 p -74.82 82.24 2.13 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.312 0.577 . . . . 74.3 111.101 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -98.67 131.56 44.74 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.083 -0.508 . . . . 62.11 111.487 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HB3' HD21 ' A' ' 19' ' ' LEU . 98.5 m-85 -70.55 -50.14 40.57 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.279 -0.419 . . . . 73.22 111.752 -177.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.71 -159.14 32.89 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.002 -0.545 . . . . 70.31 112.075 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.617 ' HG2' ' HG2' ' A' ' 51' ' ' LYS . 10.4 pt-20 -66.84 109.03 2.75 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.291 0.567 . . . . 72.01 110.809 175.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.451 ' HB2' HG23 ' A' ' 76' ' ' VAL . 99.1 mt -73.72 127.43 32.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.141 0.496 . . . . 54.54 110.57 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -101.85 105.64 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.189 0.519 . . . . 74.2 111.298 -175.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -58.6 135.49 57.37 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.409 -0.814 . . . . 73.35 112.651 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.6 m -113.17 -62.47 1.58 Allowed 'General case' 0 N--CA 1.471 0.615 0 O-C-N 122.039 -0.413 . . . . 73.25 111.529 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.449 ' H ' ' HB2' ' A' ' 47' ' ' ASP . . . -153.9 163.17 40.49 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.299 0.571 . . . . 62.42 112.104 -178.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 51.4 tp -74.81 111.8 10.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.319 -0.622 . . . . 50.41 109.319 171.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HD3' ' OD1' ' A' ' 47' ' ' ASP . 13.4 tpt180 -63.54 -50.03 71.13 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.666 -0.243 . . . . 71.31 111.651 -172.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -176.74 147.58 0.63 Allowed 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.531 0.567 . . . . 74.35 112.531 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.467 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 43.6 mt-10 -105.93 102.38 11.82 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.972 -0.558 . . . . 73.32 110.419 171.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -81.54 113.12 20.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 121.495 0.664 . . . . 63.31 110.267 174.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -101.1 157.1 17.02 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.138 -0.483 . . . . 64.24 110.681 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.2 mt -67.42 108.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.238 0.542 . . . . 53.45 111.741 -175.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -88.94 119.48 29.5 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.364 -0.38 . . . . 71.41 110.925 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -67.67 158.32 32.49 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.199 0.444 . . . . 74.2 112.199 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.37 -17.31 28.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.374 -0.375 . . . . 72.24 111.558 174.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.34 -4.79 35.53 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.327 -0.397 . . . . 64.11 111.851 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.3 -28.66 10.3 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.318 -0.467 . . . . 22.23 113.181 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.2 m -81.98 153.64 26.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.057 0.456 . . . . 71.11 111.901 -178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -85.17 133.79 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.133 0.492 . . . . 71.14 111.404 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.4 t -84.03 167.33 16.96 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.334 0.588 . . . . 74.04 112.225 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.65 -25.07 64.63 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.758 -0.655 . . . . 64.21 110.72 176.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -76.4 131.33 39.05 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.848 -0.614 . . . . 61.51 111.623 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -94.72 149.0 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.417 -0.356 . . . . 61.2 110.765 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -92.92 -57.36 2.67 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.65 0.262 . . . . 75.31 111.23 -177.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' OE1' ' HE3' ' A' ' 101' ' ' LYS . 14.7 pt-20 -163.82 168.66 19.3 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.748 0.309 . . . . 72.4 111.22 176.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.527 ' HD3' HD13 ' A' ' 67' ' ' LEU . 45.6 mtt180 -128.18 125.63 39.43 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.565 0.579 . . . . 75.44 112.565 -174.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 28.9 m -100.05 133.29 44.66 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 116.035 -0.529 . . . . 71.22 112.091 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.59 151.6 35.88 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.076 0.55 . . . . 72.13 112.39 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.498 ' OD1' ' HD3' ' A' ' 25' ' ' ARG . 31.8 m-20 -91.24 107.62 19.33 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.048 -0.524 . . . . 71.43 111.276 171.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.427 HD12 HG21 ' A' ' 59' ' ' VAL . 77.0 mt -116.08 120.72 39.98 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.919 0.39 . . . . 73.4 110.724 176.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.726 ' NZ ' ' SD ' ' A' ' 56' ' ' MET . 71.7 mmtt -92.7 148.34 22.13 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.41 -0.359 . . . . 52.53 110.853 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 55.8 m -72.34 158.68 35.35 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.718 0.294 . . . . 51.42 111.568 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.617 ' HG2' ' HG2' ' A' ' 18' ' ' GLU . 1.9 tmtp? -58.0 -63.67 1.17 Allowed 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 116.569 -0.287 . . . . 74.22 111.578 -177.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.95 47.11 0.54 Allowed Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.102 -0.57 . . . . 71.53 113.195 -177.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -110.2 -32.2 7.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.959 0.409 . . . . 63.12 111.117 178.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.97 27.96 8.02 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 121.223 -0.513 . . . . 64.25 113.453 -178.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -139.9 178.11 7.49 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.658 -0.319 . . . . 75.21 110.72 178.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.726 ' SD ' ' NZ ' ' A' ' 49' ' ' LYS . 21.4 ptt? -145.7 168.8 19.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.926 0.393 . . . . 44.3 111.664 178.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.56 134.52 46.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.009 -0.541 . . . . 73.15 110.749 176.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.37 105.37 17.45 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.905 0.383 . . . . 73.22 110.506 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 67.5 t -97.33 120.17 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 120.944 0.402 . . . . 71.11 111.927 -173.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 15.4 t -109.47 115.1 29.3 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.911 0.386 . . . . 42.15 111.61 -178.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -103.6 151.57 38.74 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-N 116.512 -0.313 . . . . 64.13 111.676 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.47 148.6 90.25 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 122.71 2.273 . . . . 73.11 113.303 -178.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -15.07 63.45 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.725 0.639 . . . . 61.41 112.725 -177.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 43.9 t -64.02 -20.58 66.01 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.981 0.42 . . . . 73.2 111.114 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.0 t -92.84 122.69 63.37 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.188 -0.46 . . . . 74.42 111.207 179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.09 151.45 16.59 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.97 2.447 . . . . 71.54 113.637 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.527 HD13 ' HD3' ' A' ' 44' ' ' ARG . 28.7 tp -69.73 141.35 53.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.277 -0.419 . . . . 71.25 111.576 -177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -81.4 -57.63 3.4 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.028 0.751 . . . . 73.31 113.028 -170.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 59.5 41.86 18.51 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.263 0.468 . . . . 71.34 112.263 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.54 168.22 7.74 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.209 0.528 . . . . 54.42 111.651 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.89 153.35 43.39 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.495 -0.32 . . . . 72.02 110.911 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 59.0 t80 -62.64 119.05 8.49 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.795 0.331 . . . . 72.34 111.335 -178.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.44 HD22 ' N ' ' A' ' 73' ' ' ASN . 0.9 OUTLIER 71.54 19.8 5.0 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.246 0.618 . . . . 72.22 112.1 -178.159 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.77 141.21 58.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.088 0.47 . . . . 71.15 110.891 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 75' ' ' ARG . 29.4 mtp180 -72.94 112.65 9.17 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.932 -0.577 . . . . 74.43 111.128 -177.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.53 HG12 HD23 ' A' ' 107' ' ' LEU . 32.4 m -126.45 161.47 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-O 121.201 0.524 . . . . 71.34 111.891 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -143.02 154.26 43.81 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.014 0.435 . . . . 71.11 110.843 176.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.7 mt -95.3 142.66 27.44 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.527 0.565 . . . . 74.51 112.527 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 44.2 mm -75.61 -77.58 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 CA-C-N 116.067 -0.515 . . . . 62.54 110.906 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -130.78 92.23 34.87 Favored Pre-proline 0 CA--C 1.542 0.672 0 CA-C-O 120.744 0.306 . . . . 72.41 111.173 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -82.68 156.94 16.11 Favored 'Trans proline' 0 CA--C 1.546 1.095 0 C-N-CA 123.246 2.631 . . . . 23.44 114.25 177.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 27.3 pt -145.46 132.87 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.332 0.653 . . . . 74.52 110.558 173.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.04 116.0 15.29 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.12 -0.363 . . . . 53.44 110.857 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.432 ' OD2' HG23 ' A' ' 85' ' ' THR . 18.7 t70 -107.69 -76.98 0.6 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.902 0.382 . . . . 73.52 111.733 -174.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.432 HG23 ' OD2' ' A' ' 84' ' ' ASP . 30.1 p -103.34 85.88 2.56 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.491 0.662 . . . . 71.31 110.922 -178.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 86' ' ' VAL . 8.0 p -74.33 98.38 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 121.971 0.891 . . . . 53.24 110.091 176.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 90' ' ' THR . . . -53.57 -32.58 51.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.409 -0.814 . . . . 72.12 113.066 -171.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.9 p -56.24 -29.12 60.61 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.291 0.478 . . . . 71.44 112.291 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.58 8.81 35.46 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.937 0.717 . . . . 51.05 112.937 -176.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 87' ' ' ALA . 7.4 t -114.4 2.13 14.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 121.926 -0.484 . . . . 71.02 112.203 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -114.19 -173.66 2.33 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.061 0.457 . . . . 64.01 112.075 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -93.64 28.73 2.22 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.47 0.545 . . . . 74.02 112.47 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 128.12 -21.28 5.53 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 120.813 -0.708 . . . . 43.33 113.911 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.98 111.95 3.09 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.868 0.692 . . . . 75.21 112.868 -177.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -80.88 108.77 14.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.317 -0.402 . . . . 63.31 110.507 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.0 m -135.64 -179.31 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 121.185 0.517 . . . . 63.41 112.102 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -59.18 155.53 13.93 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.66 0.615 . . . . 64.04 112.66 178.105 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.426 ' CH2' HD11 ' A' ' 100' ' ' ILE . 1.3 p-90 -123.14 158.87 29.77 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.274 0.559 . . . . 71.4 112.33 -172.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -111.05 126.09 54.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 121.634 0.73 . . . . 74.42 112.737 -172.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 63.6 mt -116.51 125.1 73.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.557 -0.747 . . . . 75.41 110.937 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HE3' ' OE1' ' A' ' 43' ' ' GLU . 56.6 mtpt -90.39 143.14 27.04 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.723 -0.473 . . . . 71.13 109.723 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.95 164.0 29.38 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.054 0.761 . . . . 70.03 113.054 -174.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.3 -58.75 5.14 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.235 -0.893 . . . . 75.33 110.914 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -164.37 163.25 22.45 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.205 -0.452 . . . . 75.21 111.492 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 50.2 mt -120.02 124.76 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.083 -0.508 . . . . 74.2 111.189 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 29.2 m -123.34 179.29 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 122.282 -0.261 . . . . 74.33 111.291 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 76' ' ' VAL . 93.0 mt -81.04 151.76 28.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.856 0.36 . . . . 75.14 111.311 178.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 24.7 m -72.96 129.5 38.24 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.898 0.38 . . . . 73.52 111.955 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.57 -54.23 11.16 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.098 0.475 . . . . 73.44 111.732 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 . . . . . 0 C--O 1.253 1.269 0 CA-C-N 115.996 -0.547 . . . . 65.44 112.203 -178.987 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 mmt . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.778 0.323 . . . . 71.33 111.455 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 62.2 mtt 59.31 67.78 0.87 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.403 0.621 . . . . 63.31 111.846 -178.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -84.2 106.74 16.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.85 -0.614 . . . . 70.14 110.637 175.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.91 137.37 57.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.941 0.4 . . . . 42.41 111.562 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.42 123.62 26.27 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.112 0.482 . . . . 71.11 111.923 -179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -113.71 -176.36 2.88 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.981 -0.554 . . . . 62.11 111.227 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 159.69 -65.57 0.28 Allowed Glycine 0 CA--C 1.529 0.908 0 C-N-CA 120.889 -0.672 . . . . 40.53 113.116 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.8 pt -118.53 174.88 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 O-C-N 122.564 -0.374 . . . . 74.02 111.573 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -57.08 112.4 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-O 121.384 0.612 . . . . 61.34 111.675 176.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.412 HD12 ' N ' ' A' ' 11' ' ' ASP . 4.0 pp -60.75 -22.42 64.01 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.417 0.525 . . . . 72.41 112.417 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.412 ' N ' HD12 ' A' ' 10' ' ' LEU . 2.6 m-20 -59.23 -27.84 66.13 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.847 0.356 . . . . 62.33 111.755 176.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -100.45 -14.96 18.08 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.018 0.437 . . . . 74.13 111.242 176.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -72.06 -38.77 69.4 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.451 -0.34 . . . . 70.4 111.121 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -83.08 135.1 34.95 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 121.099 0.476 . . . . 60.35 111.565 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.3 p -125.08 -168.81 1.88 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.169 0.509 . . . . 75.03 111.895 -177.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.434 ' HB3' HD21 ' A' ' 19' ' ' LEU . 71.1 m-85 -88.83 95.88 10.47 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 122.048 -0.408 . . . . 73.13 112.097 -176.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.413 ' H ' ' HA3' ' A' ' 52' ' ' GLY . . . -73.0 -99.69 0.08 OUTLIER Glycine 0 CA--C 1.531 1.047 0 C-N-CA 121.108 -0.568 . . . . 70.14 112.504 174.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 51' ' ' LYS . 45.2 mt-10 -76.54 120.89 22.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.488 -0.419 . . . . 72.44 111.741 174.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' A' ' 16' ' ' PHE . 95.5 mt -113.6 114.9 27.1 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.588 -0.523 . . . . 75.44 109.588 171.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -125.71 129.37 49.4 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.49 0.662 . . . . 61.14 112.665 -175.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -67.66 138.12 56.09 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.313 -0.858 . . . . 73.41 112.348 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.46 ' OG ' ' HD3' ' A' ' 49' ' ' LYS . 59.1 m -113.47 -64.7 1.27 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 111.893 0.331 . . . . 53.25 111.893 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.43 168.97 24.0 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.293 0.568 . . . . 74.31 112.393 -177.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.41 HD21 ' HG3' ' A' ' 27' ' ' GLU . 64.8 tp -81.41 112.09 18.36 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.57 -0.741 . . . . 70.13 110.278 172.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -68.51 -52.64 29.94 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.81 0.338 . . . . 61.35 111.34 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -175.56 134.84 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.058 0.392 . . . . 64.23 112.058 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.532 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.3 mt-10 -93.16 98.41 11.28 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.895 -0.409 . . . . 73.45 109.895 169.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.5 m -70.41 128.08 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 120.968 0.414 . . . . 72.04 110.752 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 41' ' ' ILE . 62.6 mtt180 -100.96 168.6 9.51 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.564 0.697 . . . . 73.35 112.804 -175.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.0 mt -73.92 112.43 10.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.312 -0.858 . . . . 71.4 111.116 -178.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.581 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.5 tt0 -84.96 115.0 22.56 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.861 0.362 . . . . 73.33 111.081 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -55.76 144.9 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.195 -0.457 . . . . 52.42 111.217 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -55.49 -24.01 29.09 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.365 0.505 . . . . 60.12 112.365 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.76 -37.9 74.45 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.007 0.432 . . . . 74.4 111.552 173.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.52 -17.24 5.57 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.35 -0.453 . . . . 53.31 113.098 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.4 m -94.77 148.83 21.88 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 122.31 -0.523 . . . . 74.33 111.754 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.581 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 34.1 t -82.38 143.62 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 120.949 0.404 . . . . 71.42 111.794 -177.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -94.02 178.84 5.52 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.037 0.446 . . . . 52.14 111.771 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -85.07 -21.42 29.36 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.3 -0.409 . . . . 64.45 111.29 177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -69.74 136.63 51.18 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.474 -0.33 . . . . 74.35 110.805 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.493 ' HA ' ' HG2' ' A' ' 29' ' ' ARG . 50.7 mt -90.39 144.73 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-O 121.339 0.59 . . . . 74.23 111.858 -175.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.513 ' HG3' ' HG3' ' A' ' 43' ' ' GLU . 28.9 tptp -97.9 -59.18 1.82 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.626 -0.715 . . . . 42.43 110.904 179.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.513 ' HG3' ' HG3' ' A' ' 42' ' ' LYS . 36.9 mt-10 -145.92 170.21 17.05 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.993 0.425 . . . . 75.42 111.089 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 54.5 mtt180 -128.1 119.05 24.55 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.778 0.431 . . . . 53.21 111.367 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 62.9 m -100.99 131.42 46.88 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 112.27 0.47 . . . . 63.21 112.27 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.482 ' OH ' HD12 ' A' ' 67' ' ' LEU . 39.6 m-85 -125.08 156.33 38.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.719 0.407 . . . . 72.32 111.38 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -99.97 123.04 43.78 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.693 -0.23 . . . . 71.34 111.413 173.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.499 HD12 HG21 ' A' ' 59' ' ' VAL . 51.6 mt -119.72 130.21 54.89 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.805 0.336 . . . . 75.43 111.498 176.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.507 ' HE3' ' SD ' ' A' ' 56' ' ' MET . 14.3 mptt -80.83 115.54 20.37 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.624 0.249 . . . . 75.35 110.834 173.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.6 t -101.26 108.75 20.47 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.679 0.276 . . . . 74.33 111.187 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 18' ' ' GLU . 17.5 tppt? -69.38 -38.24 77.94 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.877 0.37 . . . . 64.24 111.485 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.413 ' HA3' ' H ' ' A' ' 17' ' ' GLY . . . -66.69 -39.32 93.67 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 121.037 -0.601 . . . . 72.44 113.074 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.417 ' HG2' ' HZ2' ' A' ' 98' ' ' TRP . 6.2 tp-100 -88.12 -21.63 24.56 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.981 0.42 . . . . 71.23 111.539 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.91 26.84 73.87 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 121.421 -0.419 . . . . 63.54 112.853 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -135.56 158.38 44.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.982 0.42 . . . . 72.51 111.708 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.507 ' SD ' ' HE3' ' A' ' 49' ' ' LYS . 63.8 mtm -93.56 107.73 19.55 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.638 -0.505 . . . . 71.41 109.638 168.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.457 HD12 HD12 ' A' ' 100' ' ' ILE . 24.2 pt -94.71 134.83 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.465 0.174 . . . . 64.13 111.393 -174.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -90.6 104.94 17.46 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.36 0.6 . . . . 75.4 111.204 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 91.9 t -96.59 128.37 47.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.91 -0.587 . . . . 75.12 111.31 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.624 ' HB2' ' HG2' ' A' ' 101' ' ' LYS . 48.9 m -123.08 137.82 54.83 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.946 0.403 . . . . 65.02 111.891 -176.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.4 pt -124.42 147.81 56.43 Favored Pre-proline 0 N--CA 1.472 0.671 0 CA-C-N 116.213 -0.449 . . . . 63.34 110.798 177.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.36 150.54 86.82 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 122.298 1.999 . . . . 72.42 112.482 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -52.13 -32.94 37.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.763 0.653 . . . . 64.15 112.763 -176.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.8 m -53.46 -32.81 51.69 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.233 0.457 . . . . 71.42 112.233 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.0 t -82.08 116.15 61.73 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.616 -0.265 . . . . 43.52 110.748 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -49.74 141.43 27.67 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.163 2.575 . . . . 73.41 113.755 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.57 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 31.6 tp -52.63 138.0 29.44 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.302 -0.408 . . . . 50.24 110.844 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.523 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 24.7 mmmt -79.97 -57.55 3.59 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.621 0.6 . . . . 74.24 112.621 -170.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.57 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 39.2 mt-10 57.86 39.57 26.74 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 112.592 0.59 . . . . 64.13 112.592 177.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -70.66 172.69 8.23 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.168 0.508 . . . . 74.31 112.056 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.577 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 5.8 m-20 -70.17 157.72 37.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.381 0.61 . . . . 65.22 112.084 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.425 ' O ' ' HB2' ' A' ' 73' ' ' ASN . 7.6 t80 -70.66 117.38 12.11 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.793 -0.639 . . . . 72.35 110.902 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 72' ' ' TYR . 46.9 m-80 74.92 21.82 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.592 0.757 . . . . 64.43 112.069 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.577 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -74.95 141.63 44.04 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.963 0.357 . . . . 51.4 111.963 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.492 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 70.7 mtm180 -67.45 116.16 7.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.599 -0.273 . . . . 71.01 110.717 178.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.52 140.03 50.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-O 121.042 0.449 . . . . 75.41 112.171 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.431 ' HG3' HG23 ' A' ' 106' ' ' VAL . 8.1 pt-20 -124.53 157.16 35.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.232 0.539 . . . . 64.15 111.025 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.95 132.13 45.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.262 -0.427 . . . . 72.0 111.777 -176.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.585 HG22 ' ND2' ' A' ' 80' ' ' ASN . 50.0 mm -63.62 -72.61 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 116.28 -0.418 . . . . 64.54 111.364 177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.585 ' ND2' HG22 ' A' ' 79' ' ' ILE . 41.0 m-80 -125.32 89.96 51.64 Favored Pre-proline 0 N--CA 1.476 0.858 0 CA-C-O 120.573 0.225 . . . . 52.23 110.452 174.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.87 147.7 15.24 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.202 2.601 . . . . 64.22 114.352 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 101' ' ' LYS . 38.4 pt -140.04 149.14 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.967 0.413 . . . . 72.44 110.78 172.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.14 116.51 28.87 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.916 0.388 . . . . 70.25 110.816 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.536 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . 17.9 t70 -83.67 158.38 21.86 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.479 0.657 . . . . 74.12 112.442 -174.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.4 m -139.26 -8.72 1.3 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.854 -0.612 . . . . 70.41 111.462 176.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.458 HG22 HG22 ' A' ' 90' ' ' THR . 9.8 p -86.6 -10.71 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 121.938 -0.476 . . . . 53.34 111.382 -176.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.75 -13.53 10.58 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.476 0.547 . . . . 62.52 112.476 178.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.0 t -109.91 -9.93 14.76 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.024 0.44 . . . . 55.12 111.535 174.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -91.62 -57.2 2.84 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.336 -0.393 . . . . 74.21 111.816 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.458 HG22 HG22 ' A' ' 86' ' ' VAL . 9.8 t -85.93 -23.03 27.14 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.994 0.426 . . . . 71.34 111.274 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -113.67 104.77 12.57 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.248 -0.433 . . . . 73.34 109.859 174.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -79.55 107.9 12.67 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 73.42 111.975 -172.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.37 12.43 67.43 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 121.459 -0.4 . . . . 64.12 113.642 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.15 -31.89 23.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 122.385 -0.479 . . . . 72.4 112.21 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.497 ' HA ' ' HE1' ' A' ' 99' ' ' TYR . 33.5 t70 -68.69 141.92 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.891 0.377 . . . . 61.12 111.751 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.62 -78.62 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 120.888 0.375 . . . . 65.43 110.751 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.95 -61.22 1.61 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 116.584 -0.28 . . . . 70.14 110.812 174.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.417 ' HZ2' ' HG2' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -172.37 143.02 1.37 Allowed 'General case' 0 C--O 1.247 0.965 0 CA-C-O 122.545 1.164 . . . . 72.31 113.982 170.388 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.497 ' HE1' ' HA ' ' A' ' 95' ' ' ASP . 53.5 m-85 -110.39 122.27 47.28 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.25 -1.341 . . . . 75.34 111.094 178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 34.6 mt -105.27 104.63 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.085 0.469 . . . . 73.44 110.46 177.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.624 ' HG2' ' HB2' ' A' ' 60' ' ' SER . 50.3 mtpt -87.42 130.26 34.73 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.997 -0.44 . . . . 71.33 111.17 -176.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.12 157.93 31.81 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.651 0.611 . . . . 50.55 112.651 -173.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 28.9 t70 -66.95 -38.37 86.01 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.469 -0.787 . . . . 64.42 111.294 175.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -169.8 161.08 8.98 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.168 -0.469 . . . . 72.54 110.951 176.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.523 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 42.3 mt -119.28 120.98 65.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 116.148 -0.478 . . . . 63.24 110.883 -179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.431 HG23 ' HG3' ' A' ' 77' ' ' GLU . 27.8 m -120.42 -179.65 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 122.218 -0.301 . . . . 44.43 111.105 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.5 128.47 35.23 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.944 0.402 . . . . 63.33 111.901 -179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.492 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 26.4 m -64.48 105.93 1.04 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.429 0.633 . . . . 65.34 111.234 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.733 ' H ' HD23 ' A' ' 109' ' ' LEU . 1.8 pt? -74.29 -8.45 56.29 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.514 -0.766 . . . . 73.23 111.91 177.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 . . . . . 0 C--O 1.257 1.479 0 CA-C-O 119.033 -0.508 . . . . 71.53 111.635 -179.704 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 112.008 0.373 . . . . 72.34 112.008 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.471 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.3 OUTLIER -129.83 124.7 33.94 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.845 0.355 . . . . 74.22 110.926 177.095 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -75.31 81.33 2.4 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.222 0.534 . . . . 74.12 111.895 -175.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -105.79 -69.39 0.82 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.099 -0.501 . . . . 72.13 110.792 174.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -111.1 130.92 55.47 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.237 -0.438 . . . . 74.33 111.076 176.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -66.98 123.34 19.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.003 0.43 . . . . 75.33 111.873 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -177.41 131.03 1.72 Allowed Glycine 0 CA--C 1.524 0.645 0 C-N-CA 121.138 -0.553 . . . . 73.12 112.584 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 pt -130.54 153.44 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 121.012 0.434 . . . . 73.41 111.643 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.75 118.91 21.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.98 0.419 . . . . 74.41 111.234 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -84.61 166.78 16.84 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.415 0.626 . . . . 73.53 112.315 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.433 ' OD2' ' HB ' ' A' ' 14' ' ' THR . 5.7 p-10 -79.33 175.03 10.98 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.439 -0.8 . . . . 74.1 112.682 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -118.06 -43.23 2.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.855 -0.612 . . . . 73.43 111.224 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.78 45.4 1.15 Allowed 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.252 0.464 . . . . 72.24 112.252 -175.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.433 ' HB ' ' OD2' ' A' ' 11' ' ' ASP . 6.0 t -65.5 -36.29 83.41 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.583 0.586 . . . . 74.02 112.583 -179.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.4 p -80.69 68.99 7.11 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.037 0.446 . . . . 61.44 111.741 -177.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.509 ' HE1' HH11 ' A' ' 55' ' ' ARG . 97.5 m-85 -62.65 -50.54 70.8 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.019 0.438 . . . . 64.51 111.56 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 114.25 -107.62 1.88 Allowed Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.291 -0.48 . . . . 72.14 113.009 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -79.02 109.16 13.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.132 0.491 . . . . 71.41 111.338 178.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 50' ' ' SER . 97.2 mt -120.92 117.47 27.41 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.97 -0.559 . . . . 74.24 111.222 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -102.62 139.06 38.7 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.987 0.423 . . . . 51.22 111.21 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' TYR . 67.5 t80 -71.98 102.06 2.85 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.275 -0.421 . . . . 71.24 110.581 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.552 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.3 t -73.29 -64.83 0.9 Allowed 'General case' 0 N--CA 1.472 0.625 0 O-C-N 122.018 -0.426 . . . . 71.01 111.864 -175.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -161.57 171.67 17.65 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.608 0.596 . . . . 75.43 112.608 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.451 HD13 ' CE2' ' A' ' 46' ' ' TYR . 37.1 tp -90.06 105.83 18.07 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.853 -0.612 . . . . 73.11 109.486 169.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 25' ' ' ARG . 16.0 tpt180 -65.82 -53.14 43.96 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.487 -0.324 . . . . 75.41 111.546 -175.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -177.01 141.21 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.247 0.462 . . . . 74.23 112.247 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -93.41 98.89 11.51 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.647 -0.501 . . . . 71.02 109.647 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 42' ' ' LYS . 31.9 m -78.16 144.78 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-O 121.303 0.573 . . . . 74.5 111.773 -174.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm180 -109.56 168.35 9.46 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.949 -0.569 . . . . 65.21 112.109 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.0 mt -80.99 141.78 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.977 -0.556 . . . . 61.54 111.164 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -95.45 150.74 19.96 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.088 0.471 . . . . 72.13 111.707 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -93.55 155.45 17.3 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.489 -0.323 . . . . 62.51 110.427 174.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -62.19 -21.34 65.02 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.216 0.532 . . . . 74.43 111.344 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.54 -31.89 70.97 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.917 -0.583 . . . . 62.25 111.582 172.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.53 -34.86 4.47 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 116.222 -0.444 . . . . 51.34 112.156 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.7 m -68.14 153.92 42.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.004 0.431 . . . . 74.2 111.319 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -87.28 146.33 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 120.819 0.343 . . . . 73.43 111.5 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.9 t -90.53 172.4 8.73 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.213 0.53 . . . . 72.24 112.208 -179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -81.07 -15.54 55.72 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.998 -0.546 . . . . 63.32 110.628 173.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.08 135.87 56.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.817 -0.629 . . . . 74.3 110.75 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.1 mt -92.93 142.96 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-O 120.929 0.395 . . . . 73.34 111.266 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HB3' HG23 ' A' ' 28' ' ' VAL . 29.1 tptp -98.31 -58.26 2.01 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.955 0.407 . . . . 55.2 111.267 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -164.4 166.44 20.65 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.089 0.471 . . . . 71.43 111.291 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 60' ' ' SER . 38.3 mtt180 -114.5 114.39 25.73 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.001 0.371 . . . . 75.33 112.001 -173.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.0 m -91.64 126.92 36.89 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.169 -0.469 . . . . 64.33 112.055 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CE2' HD13 ' A' ' 24' ' ' LEU . 92.8 m-85 -123.61 151.75 42.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.209 0.604 . . . . 73.21 111.527 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 22' ' ' SER . 69.5 m-20 -102.08 119.27 38.53 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.238 -0.437 . . . . 75.33 110.938 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.642 HD12 HG21 ' A' ' 59' ' ' VAL . 39.6 mt -114.55 141.22 48.02 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.987 0.422 . . . . 75.51 111.922 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.552 ' HG2' ' HB2' ' A' ' 22' ' ' SER . 29.0 mmmt -96.21 124.54 40.25 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.0 -0.545 . . . . 73.1 111.121 -178.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HA ' HD23 ' A' ' 19' ' ' LEU . 29.1 t -103.39 106.15 16.59 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.894 0.378 . . . . 52.3 111.477 177.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -74.3 140.77 45.14 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.005 0.431 . . . . 53.22 111.244 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 102.94 -62.82 0.45 Allowed Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.803 -0.519 . . . . 74.02 111.803 -177.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -75.4 -22.85 57.12 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.992 0.425 . . . . 71.14 111.032 172.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.21 28.64 73.84 Favored Glycine 0 CA--C 1.525 0.706 0 C-N-CA 121.376 -0.44 . . . . 45.5 112.625 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.509 HH11 ' HE1' ' A' ' 16' ' ' PHE . 5.6 ptm180 -110.88 150.12 29.63 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.27 0.557 . . . . 62.05 111.448 -174.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.0 OUTLIER -110.16 131.25 55.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.897 -0.592 . . . . 63.52 110.904 175.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 100' ' ' ILE . 24.4 pt -115.02 142.99 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 116.523 -0.308 . . . . 64.42 111.359 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.614 HE22 ' HB2' ' A' ' 97' ' ' ASP . 2.2 mp0 -89.99 104.99 17.5 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.82 0.343 . . . . 71.14 110.572 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.642 HG21 HD12 ' A' ' 48' ' ' LEU . 87.2 t -100.6 129.94 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 122.079 -0.388 . . . . 70.54 111.424 -178.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.496 ' HB3' ' HG2' ' A' ' 101' ' ' LYS . 38.2 t -127.7 151.14 49.34 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.336 0.589 . . . . 62.43 112.275 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.9 pt -134.42 141.04 37.56 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 115.861 -0.609 . . . . 72.4 110.609 176.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.425 ' HG2' HG23 ' A' ' 65' ' ' VAL . 15.5 Cg_endo -56.35 152.25 40.25 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.4 2.067 . . . . 74.24 112.936 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.59 -30.12 19.82 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.301 0.852 . . . . 73.3 113.301 -177.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.5 p -67.26 -20.26 65.63 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.412 0.523 . . . . 64.53 112.412 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.425 HG23 ' HG2' ' A' ' 62' ' ' PRO . 53.2 t -84.78 132.27 46.79 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 120.536 0.208 . . . . 61.01 111.37 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.04 158.98 8.14 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.114 2.543 . . . . 74.14 113.818 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 58.5 tp -76.0 129.65 37.2 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.954 -0.566 . . . . 63.21 111.77 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HG2' ' HB ' ' A' ' 105' ' ' ILE . 0.0 OUTLIER -86.88 123.46 32.04 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.113 0.482 . . . . 70.42 111.366 174.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -116.72 49.28 1.18 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.715 -0.675 . . . . 71.4 111.397 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -84.4 177.01 8.31 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.948 0.722 . . . . 72.5 112.948 -174.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.3 159.25 15.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.553 -0.749 . . . . 71.31 111.624 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.615 ' HA ' ' O ' ' A' ' 21' ' ' PHE . 90.1 t80 -59.86 -35.35 74.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.298 0.481 . . . . 74.22 112.298 -179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.432 ' ND2' ' HD2' ' A' ' 72' ' ' TYR . 5.5 m120 -93.73 2.65 56.21 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 122.133 -0.355 . . . . 35.4 111.474 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.17 135.04 42.81 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.015 0.436 . . . . 62.23 111.802 -177.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.604 HH11 ' HA ' ' A' ' 110' ' ' GLU . 82.5 mtt180 -79.53 126.42 30.85 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.166 -0.47 . . . . 54.31 110.327 176.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.2 m -129.28 142.45 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-O 121.284 0.564 . . . . 72.0 112.516 -178.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -131.25 170.53 14.47 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.928 -0.578 . . . . 64.13 110.773 177.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 87.4 mt -114.3 133.36 55.72 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.866 0.365 . . . . 71.12 111.923 -176.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.591 HG22 ' ND2' ' A' ' 80' ' ' ASN . 50.1 mm -64.97 -65.58 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.158 -0.474 . . . . 63.12 111.645 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.591 ' ND2' HG22 ' A' ' 79' ' ' ILE . 56.2 m-80 -129.04 89.24 49.18 Favored Pre-proline 0 N--CA 1.474 0.744 0 O-C-N 122.18 -0.325 . . . . 63.51 110.669 174.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.04 141.7 13.26 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.927 2.418 . . . . 72.32 114.07 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.5 pt -133.34 129.66 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.982 0.42 . . . . 63.43 110.787 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.86 114.26 8.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.865 0.364 . . . . 43.25 110.825 175.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -76.45 124.73 28.02 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.447 0.641 . . . . 71.42 111.878 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 34.0 p -117.27 30.32 7.38 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.676 -0.693 . . . . 71.31 111.067 177.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.4 t -112.68 -48.38 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 120.856 0.36 . . . . 74.4 111.509 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.75 -9.71 46.31 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.298 0.481 . . . . 72.25 112.298 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.1 p -63.86 95.96 0.12 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.94 0.4 . . . . 75.24 111.776 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 65.37 15.59 10.1 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.162 0.801 . . . . 41.21 113.162 174.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 9.4 t -72.34 -24.42 61.29 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.934 0.397 . . . . 75.33 111.695 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -81.12 161.06 24.26 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.051 0.453 . . . . 73.01 111.833 -176.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.1 pm0 -90.82 16.23 9.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.218 -0.446 . . . . 55.22 111.965 -177.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -177.79 -41.53 0.06 OUTLIER Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.205 -0.522 . . . . 70.31 113.067 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.86 69.05 1.36 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.173 0.511 . . . . 43.5 112.25 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -83.44 97.01 8.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.388 -0.369 . . . . 71.32 110.521 173.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.8 m -124.12 168.3 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.214 0.531 . . . . 72.22 112.356 -176.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.614 ' HB2' HE22 ' A' ' 58' ' ' GLN . 4.6 m-20 -66.35 177.71 1.41 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 115.668 -0.696 . . . . 75.33 112.517 -178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.41 ' CH2' HD11 ' A' ' 100' ' ' ILE . 0.7 OUTLIER -72.74 152.28 41.71 Favored 'General case' 0 C--O 1.25 1.111 0 N-CA-C 114.618 1.34 . . . . 63.03 114.618 -167.683 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.508 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 51.6 m-85 -110.95 136.66 49.63 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.766 -1.561 . . . . 75.14 111.34 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.534 HD12 HD12 ' A' ' 57' ' ' ILE . 51.1 mt -114.72 105.5 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.182 0.515 . . . . 72.32 109.62 171.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.506 ' O ' HG12 ' A' ' 82' ' ' ILE . 38.0 mtmt -96.19 133.1 40.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.996 0.427 . . . . 74.4 111.09 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.38 158.44 26.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.464 0.649 . . . . 72.14 112.702 -172.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 19.9 t70 -59.58 -37.48 78.61 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.263 -0.881 . . . . 71.31 110.976 171.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -170.7 152.86 3.88 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.866 -0.606 . . . . 64.53 110.787 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.416 ' HB ' ' HG2' ' A' ' 68' ' ' LYS . 68.0 mt -108.93 118.82 57.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.767 -0.652 . . . . 74.34 110.953 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.8 m -127.16 164.69 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 121.038 0.447 . . . . 71.15 112.071 -177.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 90.6 mt -76.81 137.64 39.35 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.39 0.614 . . . . 73.01 112.236 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.418 HG22 ' N ' ' A' ' 109' ' ' LEU . 5.1 m -84.14 167.74 16.46 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.924 -0.58 . . . . 75.01 110.375 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.418 ' N ' HG22 ' A' ' 108' ' ' THR . 91.1 mt -59.14 102.36 0.13 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.132 0.492 . . . . 73.2 111.826 177.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.604 ' HA ' HH11 ' A' ' 75' ' ' ARG . 49.5 mt-10 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 118.577 -0.725 . . . . 51.22 110.983 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.803 0.335 . . . . 61.43 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 42.5 tpp -166.78 141.17 4.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.445 -0.343 . . . . 64.53 110.848 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -101.29 120.87 40.9 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.694 0.283 . . . . 75.31 111.097 177.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.428 HD22 ' N ' ' A' ' 4' ' ' LEU . 2.9 mm? -117.38 -176.76 3.07 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.1 0.476 . . . . 71.21 111.136 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -129.53 83.89 2.17 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.236 0.541 . . . . 70.32 110.968 176.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -80.51 76.28 7.35 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.33 0.586 . . . . 54.21 110.73 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.79 150.53 22.43 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.91 -0.662 . . . . 74.45 113.02 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 pt -111.19 -176.57 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 120.993 0.425 . . . . 72.44 111.638 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.414 ' O ' HG13 ' A' ' 9' ' ' VAL . 6.4 p -80.35 101.77 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.546 0.688 . . . . 72.32 111.132 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.529 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -70.94 -74.87 0.14 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.316 -0.402 . . . . 74.15 111.152 -179.247 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.408 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 3.1 m-20 -83.65 164.91 19.4 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.027 0.441 . . . . 54.21 111.404 173.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.515 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -67.77 136.98 55.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.949 -0.568 . . . . 72.2 111.536 -173.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -61.67 97.6 0.08 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.339 -0.392 . . . . 64.41 110.775 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.5 p -61.95 107.79 0.92 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.146 0.498 . . . . 74.5 111.44 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.6 127.08 33.87 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.327 0.584 . . . . 73.33 112.355 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -134.58 152.8 52.03 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.337 -0.392 . . . . 71.1 111.158 177.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.94 -109.42 1.88 Allowed Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.265 -0.493 . . . . 55.23 112.2 174.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -103.9 114.05 28.03 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.475 0.655 . . . . 55.2 111.215 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.4 mt -90.77 122.02 33.15 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 122.091 -0.381 . . . . 75.4 110.055 176.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -102.79 123.31 46.23 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.302 0.573 . . . . 64.53 112.198 -176.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -67.49 143.57 56.12 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.253 -0.885 . . . . 61.5 111.456 -179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.1 p -123.53 -62.94 1.27 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.792 0.294 . . . . 72.52 111.792 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.61 164.14 36.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.248 0.547 . . . . 65.34 112.327 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.61 115.04 9.32 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.888 -0.596 . . . . 75.42 110.707 173.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 8.4 tpt180 -73.04 -59.72 2.57 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.948 0.404 . . . . 71.35 111.493 -176.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 -161.92 139.68 8.82 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.043 0.386 . . . . 70.2 112.043 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -99.8 99.96 10.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.396 -0.594 . . . . 73.24 109.396 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' HB2' ' A' ' 42' ' ' LYS . 16.0 m -68.19 87.98 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.784 0.802 . . . . 63.43 111.254 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 46.8 mtt180 -82.07 155.91 24.85 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.884 -0.598 . . . . 61.12 111.825 -176.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.651 HG12 ' HE2' ' A' ' 42' ' ' LYS . 54.2 mt -68.63 107.47 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 115.862 -0.608 . . . . 70.41 111.829 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -84.45 112.61 20.53 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.034 0.445 . . . . 64.03 110.227 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -60.04 164.72 3.79 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.798 -0.637 . . . . 61.54 112.51 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.2 -32.07 64.05 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.304 0.573 . . . . 72.42 110.911 176.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.24 -8.22 43.89 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.633 -0.712 . . . . 74.32 111.865 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.04 -3.49 82.62 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.231 -0.509 . . . . 73.12 113.027 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.4 p -84.15 155.21 22.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.859 0.361 . . . . 71.21 111.479 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 43.9 t -95.74 124.31 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.885 0.374 . . . . 75.32 111.563 -178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 t -85.7 152.72 22.85 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.353 -0.385 . . . . 60.01 111.446 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.85 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.937 0.398 . . . . 64.14 111.029 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.85 143.05 58.2 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.244 0.545 . . . . 71.32 111.806 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 31.1 mt -113.06 145.93 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 116.192 -0.458 . . . . 73.05 111.672 -175.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.651 ' HE2' HG12 ' A' ' 30' ' ' ILE . 73.9 mmtt -78.76 -50.66 10.99 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.233 0.539 . . . . 52.31 110.176 170.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.84 168.18 8.93 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.732 -0.667 . . . . 74.34 111.404 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' SER . 58.3 mtt180 -114.87 117.19 29.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.694 0.398 . . . . 74.34 112.032 -173.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.1 m -96.32 132.42 41.82 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.338 -0.392 . . . . 74.32 111.788 -179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -122.97 153.97 39.03 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.679 0.391 . . . . 62.22 111.659 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.424 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 61.4 m-20 -88.48 113.17 23.78 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.693 0.282 . . . . 64.3 111.664 175.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 59' ' ' VAL . 67.5 mt -113.19 122.14 46.6 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.011 0.434 . . . . 75.23 110.865 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HE2' ' HG3' ' A' ' 56' ' ' MET . 1.1 mptm? -94.5 141.12 28.96 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.094 0.474 . . . . 74.32 112.076 -178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.45 ' HB2' ' HG2' ' A' ' 55' ' ' ARG . 19.6 m -108.89 107.7 18.19 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.514 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -58.91 153.41 17.36 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.198 0.523 . . . . 73.44 111.84 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.9 -45.88 3.38 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.246 -0.502 . . . . 74.24 112.606 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -85.08 -27.59 26.2 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.893 0.378 . . . . 65.11 111.139 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.38 43.59 94.73 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 121.427 -0.416 . . . . 34.51 113.132 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.45 ' HG2' ' HB2' ' A' ' 50' ' ' SER . 15.8 ptt180 -117.84 148.95 41.62 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.213 0.53 . . . . 72.22 111.86 -176.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.474 ' N ' ' SD ' ' A' ' 56' ' ' MET . 3.3 mpp? -111.8 108.4 17.79 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.824 -0.625 . . . . 74.11 110.055 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.5 pt -98.1 144.71 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.715 0.293 . . . . 72.0 111.091 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 87.4 mm-40 -97.48 105.05 17.13 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.055 0.455 . . . . 75.42 110.973 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.615 HG21 HD12 ' A' ' 48' ' ' LEU . 98.9 t -107.19 128.31 62.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 116.442 -0.345 . . . . 74.0 110.823 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 31.5 t -126.46 134.72 50.88 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.295 0.48 . . . . 63.33 112.295 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.6 pt -115.13 143.98 31.27 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 116.271 -0.422 . . . . 74.11 111.192 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.65 147.38 60.1 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.585 2.19 . . . . 74.1 113.193 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.03 -16.89 20.75 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.057 0.762 . . . . 45.44 113.057 -176.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 m -74.96 -4.53 38.73 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.025 0.38 . . . . 41.41 112.025 177.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.8 t -102.19 131.43 22.62 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 122.487 0.315 . . . . 74.4 111.201 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.99 146.03 17.91 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.003 2.468 . . . . 75.51 113.869 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.01 136.83 50.81 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.939 -0.573 . . . . 74.42 111.686 -178.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -87.68 133.2 33.88 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.168 0.508 . . . . 75.42 112.12 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -117.9 30.92 6.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.644 -0.707 . . . . 64.3 111.161 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -64.54 161.39 17.49 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.637 0.606 . . . . 75.24 112.637 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -83.49 163.58 20.38 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.636 -0.711 . . . . 53.1 112.102 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -64.17 120.92 13.02 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.25 -0.432 . . . . 74.0 111.002 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 66.4 34.3 6.38 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 64.12 111.865 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.58 118.68 20.22 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.471 -0.331 . . . . 71.43 111.198 175.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -60.11 108.87 0.84 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.877 0.37 . . . . 63.43 111.663 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.483 HG12 HD23 ' A' ' 107' ' ' LEU . 35.0 m -126.85 169.75 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.407 0.622 . . . . 74.05 111.817 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.87 157.96 44.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.043 -0.526 . . . . 61.24 110.697 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 93.5 mt -102.65 126.55 49.79 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.944 0.35 . . . . 45.22 111.944 -175.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.621 HG22 ' ND2' ' A' ' 80' ' ' ASN . 50.2 mm -56.13 -59.99 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 116.266 -0.424 . . . . 73.33 111.622 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.621 ' ND2' HG22 ' A' ' 79' ' ' ILE . 61.0 m-80 -137.03 91.56 14.82 Favored Pre-proline 0 N--CA 1.473 0.702 0 O-C-N 122.237 -0.289 . . . . 52.15 111.257 174.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -81.75 141.47 12.18 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.019 2.479 . . . . 73.51 113.615 176.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -141.78 131.26 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-O 121.042 0.449 . . . . 73.32 111.231 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.34 110.11 9.42 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 122.227 -0.296 . . . . 74.42 110.457 176.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -114.07 -146.59 0.41 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 121.2 -0.2 . . . . 74.32 111.264 -171.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 t -62.15 89.73 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.661 0.743 . . . . 74.33 112.494 -176.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.412 HG12 ' HB2' ' A' ' 98' ' ' TRP . 27.3 m -63.96 142.97 16.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 115.878 -0.601 . . . . 74.34 110.568 173.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.404 ' CB ' ' HB ' ' A' ' 96' ' ' VAL . . . -59.05 -32.13 69.48 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.587 0.588 . . . . 72.43 112.587 -173.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.4 p -67.75 -21.11 65.29 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.085 0.402 . . . . 73.42 112.085 178.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.32 -40.27 14.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.903 0.382 . . . . 54.13 111.809 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.3 t -81.47 -35.64 30.28 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.45 0.537 . . . . 65.42 112.45 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -94.47 120.19 34.33 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.084 0.469 . . . . 75.5 111.781 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -78.61 110.2 13.51 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.283 -0.417 . . . . 72.5 111.318 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 83.69 46.1 6.16 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 121.167 -0.54 . . . . 72.24 113.136 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -149.5 108.79 3.94 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 120.999 0.428 . . . . 35.33 111.82 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -80.25 64.57 5.11 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.571 0.7 . . . . 72.41 111.302 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 97' ' ' ASP . 18.1 t -95.07 161.78 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.945 -0.571 . . . . 64.51 111.141 -178.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.421 ' N ' HG12 ' A' ' 96' ' ' VAL . 15.0 m-20 -59.97 168.97 1.63 Allowed 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.652 0.982 . . . . 73.21 113.652 -176.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.412 ' HB2' HG12 ' A' ' 86' ' ' VAL . 3.3 p-90 -104.17 146.3 28.97 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-N 115.847 -0.615 . . . . 53.45 111.858 -177.223 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.437 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 65.9 m-85 -112.67 126.65 55.62 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.54 -0.755 . . . . 65.23 112.946 -171.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.429 ' HB ' HG22 ' A' ' 59' ' ' VAL . 57.3 mt -111.07 115.93 51.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.197 -0.91 . . . . 54.13 110.291 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -84.8 134.85 34.3 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.078 -0.389 . . . . 75.34 110.898 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.1 143.96 50.92 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.227 0.537 . . . . 54.02 112.165 -176.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.0 t70 -65.01 -40.03 94.31 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.884 -0.598 . . . . 72.21 111.422 176.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.453 ' HB3' HG13 ' A' ' 79' ' ' ILE . 22.1 t0 -170.42 161.61 8.03 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 116.383 -0.371 . . . . 75.53 110.817 178.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 36.5 mt -122.66 122.13 65.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 116.527 -0.306 . . . . 74.12 111.302 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.7 m -126.35 176.57 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.64 0.257 . . . . 72.33 111.026 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.483 HD23 HG12 ' A' ' 76' ' ' VAL . 97.2 mt -76.05 145.41 40.17 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.176 -0.327 . . . . 63.14 111.417 177.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.9 m -62.69 119.45 9.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.595 0.236 . . . . 61.05 110.873 177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 74.1 mt 61.33 36.04 17.75 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.222 0.534 . . . . 64.42 111.106 -174.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 C--O 1.255 1.377 0 CA-C-N 115.597 -0.728 . . . . 73.43 112.189 177.961 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 mtm . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.572 0.225 . . . . 75.21 111.088 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 50.3 mtm -130.68 134.91 47.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.678 0.275 . . . . 72.12 111.37 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -81.2 155.67 26.03 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.147 0.498 . . . . 72.51 111.235 175.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.451 HD22 ' N ' ' A' ' 4' ' ' LEU . 3.0 mm? -99.49 148.47 24.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 72.34 111.399 -178.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -112.13 90.98 3.49 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.337 -0.392 . . . . 71.24 111.895 -177.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -134.02 171.86 13.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.486 -0.324 . . . . 55.11 110.829 175.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.19 28.96 42.75 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 120.888 -0.672 . . . . 63.03 112.632 -176.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 33.0 pt -88.6 159.41 2.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.961 0.41 . . . . 63.31 111.588 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.9 t -102.87 128.47 55.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.826 0.346 . . . . 74.1 111.431 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.27 178.77 7.92 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.006 -0.543 . . . . 73.35 111.279 178.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -63.22 154.31 31.82 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 121.674 0.749 . . . . 53.44 112.519 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -155.59 -36.33 0.09 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.383 -0.826 . . . . 70.23 110.066 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -153.14 78.63 1.17 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.398 -0.819 . . . . 74.34 110.179 174.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -62.68 -20.39 64.81 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.784 -0.644 . . . . 64.55 112.688 -177.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.8 p -75.89 92.05 3.06 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.887 0.375 . . . . 71.1 111.12 178.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -64.61 118.86 9.48 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.34 -0.391 . . . . 61.44 111.387 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -71.12 -106.56 0.05 OUTLIER Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.068 -0.587 . . . . 65.12 113.069 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -95.3 124.8 39.53 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 122.362 -0.493 . . . . 74.4 111.996 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.6 mt -118.1 135.62 54.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.836 -0.62 . . . . 53.53 110.094 175.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HD2' ' O ' ' A' ' 73' ' ' ASN . 46.9 mtmt -132.83 138.81 47.2 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 122.036 -0.415 . . . . 73.31 112.027 -177.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -70.2 140.03 52.42 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.057 0.391 . . . . 70.33 112.057 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 94.8 p -125.97 -62.39 1.18 Allowed 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.011 0.374 . . . . 75.13 112.011 177.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -149.98 -173.6 4.48 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.494 0.553 . . . . 73.32 112.494 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 tp -104.85 123.79 48.32 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.237 -0.438 . . . . 74.14 110.754 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -73.16 -64.75 0.91 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.095 0.406 . . . . 73.5 112.095 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -170.16 143.45 2.44 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.071 0.462 . . . . 72.12 111.905 -174.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.433 ' HG2' ' HG3' ' A' ' 44' ' ' ARG . 43.3 mt-10 -106.13 108.96 20.75 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.18 -0.464 . . . . 74.53 110.481 173.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -85.95 110.05 19.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 121.304 0.573 . . . . 64.23 111.17 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.682 ' HG2' HG12 ' A' ' 41' ' ' ILE . 73.7 mtm180 -99.9 178.48 4.8 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.474 0.654 . . . . 63.12 112.761 -174.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.06 124.17 39.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 115.496 -0.774 . . . . 71.5 110.639 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -98.35 133.78 42.28 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.999 0.428 . . . . 74.43 111.698 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -68.94 143.72 54.36 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.249 -0.432 . . . . 72.41 110.741 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.59 -17.68 48.02 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.139 0.495 . . . . 75.11 111.636 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.12 -39.75 71.86 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.069 0.461 . . . . 75.03 111.253 174.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.5 -46.22 0.82 Allowed Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.372 -0.442 . . . . 73.44 112.916 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 77.2 p -61.46 160.79 10.42 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 120.991 0.424 . . . . 35.53 111.931 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.4 t -107.97 136.89 41.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-O 121.024 0.44 . . . . 75.11 111.793 -177.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.4 t -79.83 168.88 18.7 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.272 0.558 . . . . 73.44 111.895 178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.42 -26.74 55.82 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.206 -0.452 . . . . 71.11 111.813 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.68 142.69 57.94 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.268 0.556 . . . . 53.54 111.453 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.682 HG12 ' HG2' ' A' ' 29' ' ' ARG . 24.1 mt -115.48 145.04 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-N 116.066 -0.516 . . . . 54.25 111.934 -172.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -78.58 -57.79 3.59 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.146 0.498 . . . . 72.44 110.389 173.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.44 167.75 25.02 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.157 0.503 . . . . 64.4 111.478 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.433 ' HG3' ' HG2' ' A' ' 27' ' ' GLU . 44.8 ttm180 -125.51 123.71 39.76 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.927 0.394 . . . . 72.35 111.752 -172.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 16.9 m -102.3 128.84 48.68 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 116.2 -0.455 . . . . 75.5 112.175 -177.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -109.9 160.26 16.53 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.71 0.404 . . . . 74.32 111.369 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -98.05 124.1 42.39 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.476 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.439 ' HB2' HG13 ' A' ' 57' ' ' ILE . 73.3 mt -123.52 130.32 52.51 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.151 0.5 . . . . 74.23 111.535 178.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.418 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 1.8 mmmp? -80.77 128.57 33.79 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.444 -0.344 . . . . 75.43 110.64 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -112.85 136.29 52.65 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.235 0.458 . . . . 61.22 112.235 -175.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.3 90.56 7.16 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.232 -0.44 . . . . 71.12 111.036 173.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.09 -130.35 1.12 Allowed Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.707 -0.759 . . . . 73.11 113.824 -178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.06 28.39 0.11 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 112.913 0.708 . . . . 71.05 112.913 -174.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 77.0 20.25 76.22 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.808 -0.71 . . . . 70.11 113.557 -178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -115.96 156.61 25.93 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.825 0.345 . . . . 71.11 110.935 177.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -108.55 177.62 4.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.691 0.281 . . . . 72.43 110.492 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.439 HG13 ' HB2' ' A' ' 48' ' ' LEU . 36.4 pt -131.62 138.24 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.962 0.41 . . . . 44.44 111.81 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.51 ' NE2' ' HB2' ' A' ' 97' ' ' ASP . 78.4 mt-30 -104.74 105.68 15.86 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.033 0.444 . . . . 74.11 110.622 175.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 93.5 t -100.07 126.59 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 112.308 0.484 . . . . 51.2 112.308 -173.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 14.3 t -114.03 123.07 48.78 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.712 0.291 . . . . 65.02 111.749 -176.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 pt -114.03 155.1 45.85 Favored Pre-proline 0 CA--C 1.543 0.708 0 CA-C-N 116.543 -0.299 . . . . 74.32 111.368 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.27 138.73 80.23 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 122.778 2.319 . . . . 73.24 113.297 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.74 -13.81 62.43 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.668 0.618 . . . . 73.12 112.668 -176.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.1 m -73.83 0.67 12.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 120.938 0.399 . . . . 71.52 111.169 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 94.5 t -101.77 129.96 25.52 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 122.816 0.446 . . . . 74.23 110.849 176.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -57.46 156.18 27.5 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.658 2.239 . . . . 74.12 113.438 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.553 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 39.7 tp -69.45 145.75 52.53 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.088 -0.506 . . . . 71.11 111.563 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.488 ' HE2' ' O ' ' A' ' 105' ' ' ILE . 13.5 mptt -93.62 -66.13 0.94 Allowed 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.986 0.736 . . . . 51.33 112.986 -176.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 45.1 mt-10 60.88 49.28 6.09 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.861 0.319 . . . . 65.44 111.861 -177.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.51 176.41 1.11 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.479 0.657 . . . . 63.31 112.644 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 16.7 m-20 -71.77 153.85 41.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.703 -0.68 . . . . 73.33 111.843 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -67.49 119.57 12.52 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.95 -0.568 . . . . 70.23 111.263 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 20' ' ' LYS . 40.5 m-80 61.97 34.33 16.8 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.584 0.587 . . . . 74.32 112.584 -177.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -88.03 142.18 27.98 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.719 -0.219 . . . . 73.02 111.142 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 75' ' ' ARG . 0.0 OUTLIER -62.18 115.96 4.58 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.383 0.611 . . . . 63.5 112.388 179.837 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.401 HG12 HD23 ' A' ' 107' ' ' LEU . 33.5 m -125.31 146.94 30.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.587 -0.733 . . . . 71.42 111.208 177.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -125.65 162.99 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.313 0.577 . . . . 73.22 111.316 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 59' ' ' VAL . 86.7 mt -110.17 137.67 47.59 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.226 -0.443 . . . . 75.22 111.731 -176.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 79' ' ' ILE . 1.9 mp -67.11 -68.42 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 116.286 -0.416 . . . . 65.11 110.925 176.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 102' ' ' ALA . 80.9 m-20 -122.72 85.99 49.56 Favored Pre-proline 0 N--CA 1.473 0.693 0 CA-C-N 116.679 -0.237 . . . . 75.02 111.191 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.73 129.81 6.52 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.808 2.339 . . . . 64.43 113.449 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.8 pt -137.86 130.97 41.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 121.162 0.506 . . . . 70.23 111.046 174.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -80.66 127.65 32.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.775 0.321 . . . . 72.51 111.425 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.43 131.63 51.66 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.152 0.427 . . . . 72.51 112.152 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -76.42 80.63 3.14 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.549 0.69 . . . . 73.22 109.43 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.504 HG22 ' H ' ' A' ' 87' ' ' ALA . 10.7 p -125.34 174.0 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 115.477 -0.783 . . . . 74.4 110.894 -172.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.504 ' H ' HG22 ' A' ' 86' ' ' VAL . . . 79.5 -57.87 0.39 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.341 0.657 . . . . 43.41 111.714 176.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.0 t -62.08 -12.43 19.15 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.058 0.392 . . . . 75.22 112.058 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -102.37 0.72 34.48 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.017 0.377 . . . . 42.04 112.017 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 84.1 m -119.08 -38.55 3.04 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.254 0.549 . . . . 62.21 111.045 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -93.65 -177.74 4.48 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.017 -0.538 . . . . 70.53 110.675 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -65.76 -16.34 63.7 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.186 0.517 . . . . 75.13 111.351 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 101.36 54.84 0.93 Allowed Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.162 -0.472 . . . . 64.33 113.011 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.36 2.14 20.5 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.304 0.573 . . . . 52.3 111.347 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -82.52 107.58 15.27 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.227 0.536 . . . . 63.55 111.148 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.9 t -87.94 -34.59 7.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.049 0.452 . . . . 73.22 111.548 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.51 ' HB2' ' NE2' ' A' ' 58' ' ' GLN . 5.4 m-20 -84.66 146.93 27.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.088 -0.506 . . . . 72.44 111.16 -178.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -82.83 142.18 31.72 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.651 0.739 . . . . 73.53 112.607 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.2 138.93 34.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.483 -0.78 . . . . 63.12 112.061 -178.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 50.5 mt -124.67 114.64 41.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 115.724 -0.671 . . . . 74.2 110.142 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -83.4 139.12 33.18 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 122.068 -0.395 . . . . 64.21 110.387 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 80' ' ' ASN . . . -141.16 160.49 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.29 0.566 . . . . 54.04 112.39 -175.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.426 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . 34.7 t70 -63.01 -55.39 26.04 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.606 -0.725 . . . . 60.11 110.986 175.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -163.19 164.85 25.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.11 -0.495 . . . . 74.24 110.896 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.488 ' O ' ' HE2' ' A' ' 68' ' ' LYS . 52.3 mt -115.04 117.34 55.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.087 0.555 . . . . 74.22 111.234 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 34.5 m -124.34 175.28 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.154 -0.341 . . . . 74.54 111.425 179.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.401 HD23 HG12 ' A' ' 76' ' ' VAL . 96.4 mt -77.12 138.13 39.33 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.723 0.297 . . . . 74.22 111.45 178.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 58.5 m -61.74 138.16 58.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.902 0.382 . . . . 60.43 111.758 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.6 mt -71.71 80.14 0.85 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 63.34 111.863 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.664 -0.684 . . . . 74.43 110.689 175.351 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.673 0.273 . . . . 63.01 110.976 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 34.4 tpp -148.95 152.92 37.19 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.874 0.369 . . . . 64.11 111.249 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -98.25 18.96 15.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.125 0.417 . . . . 61.24 112.125 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -113.43 -179.88 3.77 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.894 0.378 . . . . 65.43 111.574 -179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.48 134.8 55.05 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.46 -0.336 . . . . 63.11 111.164 179.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -106.44 -26.91 11.24 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 111.887 0.329 . . . . 74.24 111.887 -179.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.31 116.29 1.31 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 121.162 -0.542 . . . . 75.13 112.997 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 34.4 pt -86.58 136.84 22.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 121.335 0.588 . . . . 35.11 112.214 -177.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.6 t -69.63 -47.14 72.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 121.285 0.564 . . . . 75.34 110.931 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -150.35 -177.3 5.87 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.936 -0.575 . . . . 74.23 111.054 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -60.87 102.84 0.22 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.163 0.506 . . . . 75.52 110.94 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.44 ' HB3' ' HE3' ' A' ' 12' ' ' LYS . 1.0 OUTLIER -56.51 138.75 51.25 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.667 -0.697 . . . . 72.55 112.705 -172.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.444 ' CG ' HH21 ' A' ' 55' ' ' ARG . 0.7 OUTLIER -47.86 102.56 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.702 -0.681 . . . . 65.45 111.779 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.8 t -124.81 -35.91 2.64 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.083 0.468 . . . . 71.13 111.226 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.2 p -88.45 83.41 6.84 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.228 0.537 . . . . 75.13 110.707 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -82.28 142.89 31.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.12 -0.491 . . . . 72.44 111.529 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -73.21 -157.34 4.15 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 120.743 -0.741 . . . . 43.11 111.842 171.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.61 107.97 2.29 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 122.049 -0.677 . . . . 73.42 110.816 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 76' ' ' VAL . 95.3 mt -74.75 127.65 33.67 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.773 0.32 . . . . 63.3 110.58 177.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HB2' ' HD3' ' A' ' 49' ' ' LYS . 57.6 mttp -112.78 130.77 55.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.911 0.386 . . . . 61.41 111.387 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.85 132.39 48.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.92 -0.582 . . . . 63.12 111.207 177.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 m -116.75 -64.31 1.33 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.894 0.378 . . . . 72.52 111.607 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -159.68 -175.41 5.14 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.06 0.457 . . . . 70.44 111.894 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -105.89 107.24 18.14 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.166 -0.47 . . . . 72.4 110.127 175.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -59.01 -52.88 63.88 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.547 0.573 . . . . 73.33 112.547 -174.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -174.42 134.93 0.41 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.77 0.656 . . . . 51.22 112.77 -174.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -105.18 106.16 16.53 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.34 -0.391 . . . . 73.04 110.351 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -78.36 113.1 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.066 0.46 . . . . 72.33 111.505 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.645 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 96.0 mtt180 -79.95 161.96 25.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.278 0.561 . . . . 74.55 112.375 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 mt -77.01 105.5 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 115.721 -0.672 . . . . 74.0 111.267 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.437 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 64.4 tt0 -77.85 121.18 23.76 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.891 0.377 . . . . 72.44 111.23 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -65.84 147.21 53.74 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.942 0.401 . . . . 74.11 111.574 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -63.33 -13.96 44.66 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 116.122 -0.49 . . . . 74.2 111.465 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -72.51 -23.93 61.08 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.049 0.452 . . . . 74.32 111.342 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.75 -42.87 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 C-N-CA 121.442 -0.408 . . . . 72.21 112.97 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.0 m -74.5 159.88 31.66 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.093 0.473 . . . . 73.12 111.903 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 50.1 t -92.59 137.08 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.889 0.376 . . . . 55.33 111.527 -178.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.8 t -79.64 179.67 7.37 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.396 0.617 . . . . 73.34 111.884 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -78.49 -44.95 23.23 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.034 -0.53 . . . . 74.21 110.997 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -72.82 157.6 37.16 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.244 0.831 . . . . 62.52 113.244 -174.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 34.2 mt -104.06 152.44 6.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.442 -0.799 . . . . 53.33 111.699 -176.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -91.95 -58.34 2.43 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.045 0.45 . . . . 73.53 111.254 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -153.97 160.66 42.16 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 120.882 0.372 . . . . 65.11 111.217 176.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 44' ' ' ARG . 5.5 ptp85 -125.63 126.44 44.73 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.563 0.579 . . . . 54.3 112.563 -174.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 60' ' ' SER . 88.8 m -96.6 129.12 44.05 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.735 -0.666 . . . . 65.32 111.991 -178.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.441 ' OH ' HD12 ' A' ' 67' ' ' LEU . 66.1 m-85 -107.82 163.53 13.04 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-O 121.23 0.538 . . . . 71.3 112.138 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -106.94 108.35 19.82 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.58 -0.736 . . . . 73.52 111.472 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.9 mt -122.64 125.92 46.6 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 122.29 -0.256 . . . . 74.41 110.895 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HD3' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -94.11 134.48 36.5 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 121.87 -0.518 . . . . 70.44 112.022 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.9 t -100.91 118.76 37.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.149 -0.478 . . . . 71.05 111.442 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -66.6 123.84 21.18 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.52 -0.309 . . . . 71.5 111.474 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.51 -31.39 6.91 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.268 -0.491 . . . . 75.11 113.598 177.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -96.26 -12.83 23.97 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 117.256 0.528 . . . . 44.32 112.02 -177.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.1 12.83 66.1 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 114.28 0.472 . . . . 63.33 114.28 177.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.444 HH21 ' CG ' ' A' ' 13' ' ' ASP . 38.7 ptt180 -138.44 160.42 39.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 122.261 -0.553 . . . . 73.12 111.942 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.476 ' SD ' ' N ' ' A' ' 56' ' ' MET . 1.5 pmm? -102.14 147.69 26.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.857 -0.611 . . . . 72.31 111.377 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.8 pt -103.52 137.82 30.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.025 177.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.7 mm-40 -93.45 104.68 16.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.182 -0.463 . . . . 70.42 110.394 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 58.4 t -105.36 112.43 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.813 0.34 . . . . 64.31 111.728 -175.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 45' ' ' THR . 98.2 p -103.91 130.74 51.54 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.269 0.557 . . . . 72.32 111.874 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -125.21 152.36 70.81 Favored Pre-proline 0 CA--C 1.543 0.675 0 CA-C-N 116.127 -0.488 . . . . 74.21 111.095 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -51.78 142.54 41.38 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.716 2.277 . . . . 73.4 113.508 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.52 -30.81 69.97 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.925 0.393 . . . . 52.14 111.966 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.9 t -61.08 -22.74 64.9 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.087 0.47 . . . . 74.44 111.306 176.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.7 t -75.83 127.81 84.76 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 116.462 -0.336 . . . . 55.33 110.547 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.38 144.01 92.56 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.917 2.411 . . . . 74.43 113.741 -175.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.441 HD12 ' OH ' ' A' ' 46' ' ' TYR . 24.3 tp -60.45 146.71 43.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.468 -0.787 . . . . 63.3 110.608 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 68' ' ' LYS . 3.6 mptp? -88.09 -56.79 3.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.95 0.722 . . . . 63.21 112.95 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 59.65 21.95 10.65 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.569 0.581 . . . . 73.03 112.569 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.21 164.98 14.64 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.2 0.524 . . . . 51.43 112.172 -177.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -65.1 146.91 54.37 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.432 0.634 . . . . 60.31 112.568 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -62.09 123.94 19.49 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.434 -0.803 . . . . 73.44 111.627 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.0 m120 71.03 16.71 6.36 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.21 0.604 . . . . 64.43 112.53 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.21 149.06 32.03 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.149 -0.344 . . . . 75.11 111.09 175.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.56 123.85 22.38 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.911 0.386 . . . . 74.52 111.427 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.462 HG12 HD23 ' A' ' 107' ' ' LEU . 30.4 m -127.21 140.47 49.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-O 121.052 0.453 . . . . 63.14 111.075 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -123.73 153.33 41.04 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.202 0.525 . . . . 72.51 111.151 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.422 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.7 mt -93.61 146.46 23.8 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.195 -0.457 . . . . 71.55 111.732 -177.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.534 HG22 ' ND2' ' A' ' 80' ' ' ASN . 49.6 mm -77.0 -67.32 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.24 -0.436 . . . . 62.23 111.005 176.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.534 ' ND2' HG22 ' A' ' 79' ' ' ILE . 51.7 m-80 -124.42 88.19 53.4 Favored Pre-proline 0 N--CA 1.473 0.714 0 O-C-N 122.2 -0.312 . . . . 61.04 110.838 174.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.409 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . 85.8 Cg_endo -82.32 128.52 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.946 2.431 . . . . 73.43 113.868 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.6 pt -137.58 123.83 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.166 0.508 . . . . 62.44 111.02 171.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 142.42 48.79 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 122.121 -0.362 . . . . 74.13 110.381 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -119.78 143.41 47.85 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.317 0.58 . . . . 73.41 112.095 -175.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.2 p -84.42 6.62 22.6 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.939 -0.573 . . . . 42.33 111.878 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.38 -32.3 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 121.028 0.442 . . . . 40.31 111.177 176.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.95 -57.54 4.47 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.266 -0.425 . . . . 75.34 111.411 177.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.6 p -60.46 -18.06 48.92 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 112.737 0.643 . . . . 71.04 112.737 -176.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.1 -40.27 84.83 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.871 0.367 . . . . 70.41 111.798 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.8 t -108.6 -34.98 6.57 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.011 0.434 . . . . 72.14 111.509 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -75.57 104.95 6.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.889 0.376 . . . . 75.4 111.519 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.39 118.63 13.44 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.302 -0.408 . . . . 71.14 111.826 178.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 79.58 -108.1 2.67 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 121.423 -0.418 . . . . 73.43 113.912 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -153.39 137.63 16.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.971 0.415 . . . . 31.33 111.847 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -124.82 32.0 5.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.068 0.461 . . . . 75.51 111.227 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 68.2 t 74.81 -60.01 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.565 0.746 . . . . 72.03 112.669 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.61 152.54 23.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.158 0.504 . . . . 74.4 111.266 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -149.23 164.76 33.88 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.101 0.477 . . . . 74.23 111.63 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -111.05 128.65 55.93 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.029 0.751 . . . . 61.22 113.029 -171.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 66.4 mt -120.57 128.36 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.279 -0.873 . . . . 72.11 110.527 177.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -96.35 131.4 42.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.905 0.383 . . . . 74.3 110.278 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.65 162.92 24.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.513 0.673 . . . . 72.53 112.605 -176.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 26.8 t70 -78.3 -40.55 36.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.19 -0.914 . . . . 62.41 111.425 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -169.44 155.89 6.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.003 0.43 . . . . 73.35 111.46 -179.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.454 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 31.7 mt -120.92 118.68 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-N 115.892 -0.595 . . . . 74.45 110.722 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 33.9 m -122.75 168.93 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 120.934 0.397 . . . . 73.01 111.626 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.462 HD23 HG12 ' A' ' 76' ' ' VAL . 69.2 mt -74.73 133.57 42.01 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.809 0.338 . . . . 71.44 111.494 176.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.36 137.35 58.24 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.475 -0.33 . . . . 71.22 110.381 176.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.9 mt -72.17 12.62 0.41 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.093 0.775 . . . . 74.33 113.093 -173.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--O 1.25 1.114 0 C-N-CA 123.696 0.798 . . . . 71.25 112.822 176.464 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.439 ' N ' ' OE1' ' A' ' 31' ' ' GLN . 64.3 mtt . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.615 0.245 . . . . 74.2 111.278 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -176.11 150.1 0.93 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.881 0.372 . . . . 64.21 111.476 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -110.02 111.41 22.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.306 -0.406 . . . . 74.34 110.412 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -81.09 123.33 28.3 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.249 0.547 . . . . 72.43 112.247 -177.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -105.08 104.2 13.89 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.95 -0.568 . . . . 74.3 110.849 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -114.23 171.88 7.35 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.27 0.557 . . . . 74.23 111.89 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -156.57 -96.99 0.13 Allowed Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.794 -0.639 . . . . 44.13 112.107 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 40.5 pt -110.03 171.03 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 120.928 0.394 . . . . 72.32 111.413 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.6 p -147.99 113.06 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.257 0.551 . . . . 74.42 110.835 174.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -113.2 -178.14 3.31 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.221 -0.445 . . . . 61.23 111.905 -177.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -64.25 110.35 2.19 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.04 -0.527 . . . . 74.3 112.374 -175.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -130.82 -173.19 3.01 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.03 0.443 . . . . 63.23 111.413 175.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.01 119.08 14.61 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.528 0.566 . . . . 63.4 112.528 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 t -93.21 -50.57 5.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.958 -0.565 . . . . 63.24 110.503 171.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.1 m 67.26 -65.25 0.23 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.62 1.341 . . . . 65.43 114.62 170.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -52.48 -32.13 38.44 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.56 0.948 . . . . 65.31 113.56 -170.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 68.53 -113.79 5.53 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 121.021 -0.609 . . . . 74.02 113.155 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' A' ' 18' ' ' GLU . 7.3 pt-20 -83.85 108.63 16.98 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.352 0.596 . . . . 73.35 111.767 179.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 96.8 mt -88.85 153.43 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.933 -0.479 . . . . 73.53 111.306 177.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.518 ' N ' ' HE2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -102.62 112.93 25.9 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.483 -0.326 . . . . 75.12 111.075 176.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.453 ' HE1' ' CD1' ' A' ' 46' ' ' TYR . 86.0 t80 -78.82 113.25 16.74 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.254 -0.43 . . . . 73.25 111.742 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.6 p -101.19 -60.09 1.59 Allowed 'General case' 0 N--CA 1.474 0.741 0 O-C-N 122.109 -0.37 . . . . 70.22 111.919 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.16 173.95 15.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.91 0.707 . . . . 42.24 112.91 -178.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -92.65 116.65 29.2 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.525 -0.761 . . . . 73.42 110.984 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HD3' ' OD2' ' A' ' 47' ' ' ASP . 19.3 tpt180 -71.51 -54.61 10.0 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.405 0.52 . . . . 72.24 112.405 -173.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 ttm180 -164.7 146.9 8.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.081 0.467 . . . . 75.25 111.922 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HG2' ' HG2' ' A' ' 44' ' ' ARG . 37.4 mt-10 -114.03 99.39 7.61 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.018 -0.537 . . . . 64.21 110.501 175.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 27.6 m -71.91 120.57 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.358 0.599 . . . . 70.34 110.702 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 99.2 mtt180 -98.16 165.94 11.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.349 0.595 . . . . 64.04 112.301 -173.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.9 mt -69.34 112.51 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 115.659 -0.7 . . . . 72.14 111.319 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' A' ' 1' ' ' MET . 58.3 tt0 -86.51 120.18 27.56 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.14 -0.482 . . . . 60.55 110.838 -178.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.05 173.7 5.25 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.132 0.79 . . . . 74.44 113.132 -174.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -53.98 -41.5 67.97 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.55 -0.75 . . . . 65.11 112.344 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.7 -26.93 68.88 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.068 0.461 . . . . 72.34 112.053 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 110.14 -15.97 30.34 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.07 -0.586 . . . . 25.14 111.788 -171.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 m -72.14 137.84 47.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.006 0.431 . . . . 40.14 110.9 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 21.6 t -82.08 144.31 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-N 116.372 -0.377 . . . . 73.25 111.876 -175.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.8 t -95.3 176.44 6.21 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.915 0.388 . . . . 54.33 111.794 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -80.11 -29.87 39.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.943 0.401 . . . . 73.54 111.252 177.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.03 138.97 58.68 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.277 -0.42 . . . . 71.11 111.031 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 54.3 mt -101.81 147.93 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 112.059 0.392 . . . . 52.42 112.059 -175.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -94.74 -57.31 2.5 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 116.535 -0.302 . . . . 63.12 110.87 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -152.26 165.7 34.07 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.986 0.422 . . . . 64.13 111.857 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.54 ' HD3' HD13 ' A' ' 67' ' ' LEU . 64.9 mtt180 -128.8 137.66 51.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.932 0.396 . . . . 73.43 112.049 -172.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.4 m -113.57 132.49 55.7 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.369 -0.378 . . . . 62.34 111.936 -177.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.514 ' OH ' HD12 ' A' ' 67' ' ' LEU . 51.5 m-85 -109.6 157.67 18.8 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 120.774 0.321 . . . . 74.31 111.751 178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.42 ' OD2' ' HD3' ' A' ' 25' ' ' ARG . 55.3 m-20 -92.45 106.77 18.7 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.295 -0.411 . . . . 74.41 110.233 169.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.455 HD12 HG21 ' A' ' 59' ' ' VAL . 58.9 mt -115.45 134.08 55.43 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.146 0.498 . . . . 71.53 111.846 -178.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -93.96 128.74 40.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.162 -0.472 . . . . 72.41 111.003 177.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 61.5 p -91.88 165.9 13.0 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.479 0.548 . . . . 53.22 112.479 -175.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.649 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 8.3 mmpt? -96.68 -178.16 4.16 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.135 -0.484 . . . . 73.32 111.543 177.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.4 -85.85 0.05 OUTLIER Glycine 0 CA--C 1.525 0.706 0 C-N-CA 121.161 -0.542 . . . . 51.12 113.04 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -74.82 -31.63 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.87 0.367 . . . . 64.53 111.151 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.68 53.58 8.23 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 120.935 -0.65 . . . . 75.44 114.346 175.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -111.82 160.87 16.94 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.412 0.625 . . . . 71.43 111.938 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.601 ' N ' ' SD ' ' A' ' 56' ' ' MET . 0.8 OUTLIER -87.72 125.12 34.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.449 -0.796 . . . . 74.03 110.86 176.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 100' ' ' ILE . 27.0 pt -125.5 141.12 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.975 0.417 . . . . 75.03 111.823 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 22.1 mp0 -95.68 105.93 17.98 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.989 0.424 . . . . 62.22 111.325 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.463 HG22 ' HB ' ' A' ' 100' ' ' ILE . 93.4 t -100.01 128.47 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.652 0.263 . . . . 72.41 111.218 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 44' ' ' ARG . 22.6 t -118.33 138.96 52.04 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.325 0.491 . . . . 73.31 112.325 -174.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.429 HG21 HG13 ' A' ' 105' ' ' ILE . 44.7 pt -133.76 149.01 70.74 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-N 116.282 -0.417 . . . . 71.25 111.109 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.44 145.48 94.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.433 2.089 . . . . 72.01 113.125 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.81 -6.07 19.53 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.975 0.417 . . . . 64.42 112.073 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 55.3 p -74.02 -20.83 60.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.183 0.516 . . . . 74.34 110.679 172.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 56.6 t -89.78 124.8 62.93 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 115.849 -0.614 . . . . 73.2 110.864 177.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -49.73 126.42 16.44 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.813 2.342 . . . . 75.54 113.448 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.612 ' HG ' ' HG3' ' A' ' 69' ' ' GLU . 29.4 tp -56.75 126.32 26.34 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.106 -0.497 . . . . 64.11 111.074 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.485 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.3 mptp? -69.72 -63.07 1.15 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.923 0.712 . . . . 74.34 112.923 -170.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.612 ' HG3' ' HG ' ' A' ' 67' ' ' LEU . 36.7 mt-10 56.25 45.61 22.79 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.757 0.651 . . . . 62.2 112.757 176.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -75.6 -169.17 0.98 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.824 0.345 . . . . 73.04 111.854 177.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -74.94 164.73 26.25 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.627 0.603 . . . . 64.45 112.627 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -70.92 125.4 26.73 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.863 -0.608 . . . . 72.11 111.113 -178.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 59.16 31.54 21.35 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 122.854 0.462 . . . . 71.12 111.878 -175.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.65 150.8 30.84 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.517 -0.31 . . . . 75.54 111.518 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.463 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 99.3 mtt180 -68.49 106.19 2.47 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.299 0.481 . . . . 73.12 112.299 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 35.7 m -123.2 141.65 42.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.422 -0.354 . . . . 75.34 111.095 174.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -128.82 164.71 22.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.333 0.587 . . . . 75.33 111.391 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.454 ' CD2' HG12 ' A' ' 105' ' ' ILE . 87.5 mt -102.24 136.65 41.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.968 -0.56 . . . . 62.41 112.025 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.567 HG22 ' ND2' ' A' ' 80' ' ' ASN . 49.7 mm -70.96 -76.14 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 CA-C-N 116.184 -0.462 . . . . 72.23 111.417 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.567 ' ND2' HG22 ' A' ' 79' ' ' ILE . 44.8 m-80 -121.25 85.39 41.88 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.171 -0.33 . . . . 61.42 110.525 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -82.46 149.07 14.66 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.113 2.542 . . . . 51.41 114.703 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 101' ' ' LYS . 39.7 pt -128.58 139.69 51.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-O 121.171 0.51 . . . . 73.55 110.122 168.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -91.66 105.75 17.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.286 -0.416 . . . . 71.52 111.859 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -81.9 49.41 1.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.293 0.568 . . . . 74.32 112.023 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 69.3 p -59.85 -44.21 94.24 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.929 0.395 . . . . 74.34 111.721 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 35.3 m -59.4 -18.26 14.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.831 0.678 . . . . 70.22 112.831 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -44.11 86.08 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.749 0.309 . . . . 73.2 111.655 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 78.7 p -63.37 -58.74 6.11 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.908 0.385 . . . . 72.44 111.34 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' A' ' 93' ' ' GLY . . . -56.05 -36.9 68.55 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.487 0.551 . . . . 55.11 112.487 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.7 m -76.05 -53.99 7.52 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.408 0.521 . . . . 64.43 112.408 -177.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.86 -32.38 19.03 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.991 0.737 . . . . 44.22 112.991 -171.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -135.64 75.23 1.55 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 111.974 0.361 . . . . 74.15 111.974 -175.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 89' ' ' ALA . . . 44.75 -90.49 0.01 OUTLIER Glycine 0 CA--C 1.53 0.973 0 CA-C-N 115.893 -0.594 . . . . 71.11 114.463 176.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.37 80.03 0.67 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.116 0.566 . . . . 74.22 110.459 175.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -90.99 166.6 12.93 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.158 0.429 . . . . 61.34 112.158 -173.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.94 -39.95 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 113.133 0.79 . . . . 50.2 113.133 -172.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.37 140.64 30.6 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.315 0.579 . . . . 72.41 111.03 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 -139.4 165.44 27.2 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.023 -0.535 . . . . 72.32 112.238 -170.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.433 ' HA ' ' O ' ' A' ' 58' ' ' GLN . 76.2 m-85 -105.16 154.22 20.48 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.749 -0.66 . . . . 70.34 112.253 -177.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.51 HD12 HD12 ' A' ' 57' ' ' ILE . 66.7 mt -135.85 107.39 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.427 -0.806 . . . . 64.2 109.76 175.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 82' ' ' ILE . 28.3 mtpp -86.13 120.88 27.99 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.363 0.601 . . . . 72.24 111.101 -177.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.09 144.33 43.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.098 0.475 . . . . 71.04 112.165 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -56.31 -44.38 79.84 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.895 -0.593 . . . . 73.15 111.133 173.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -165.34 158.09 15.82 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.162 -0.472 . . . . 75.33 110.95 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.485 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 23.8 mt -123.43 122.46 65.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-N 116.093 -0.503 . . . . 60.34 110.915 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.5 m -124.62 177.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.608 0.242 . . . . 62.32 111.261 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 92.4 mt -76.96 137.91 39.33 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 122.411 -0.181 . . . . 74.51 110.792 174.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 75' ' ' ARG . 32.5 m -54.95 132.62 47.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.755 0.312 . . . . 42.21 111.296 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.01 -28.59 17.6 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.815 0.672 . . . . 74.11 112.815 -176.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.431 ' H ' HG22 ' A' ' 108' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.254 1.317 0 CA-C-O 118.894 -0.574 . . . . 62.15 111.861 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.492 1.67 0 N-CA-C 111.754 0.279 . . . . 72.24 111.754 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.439 ' N ' ' SD ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -145.43 138.95 26.55 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.026 0.441 . . . . 75.31 111.743 -179.68 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -98.42 -6.21 30.99 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.296 -0.411 . . . . 74.14 112.025 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.494 ' HB3' HG13 ' A' ' 86' ' ' VAL . 3.9 pp -60.25 164.85 3.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.915 0.709 . . . . 71.42 112.915 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -127.6 156.2 42.66 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.094 -0.503 . . . . 71.22 111.695 178.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -90.75 7.16 41.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 120.957 0.408 . . . . 63.41 111.539 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -144.18 152.07 23.97 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 116.366 -0.379 . . . . 44.41 112.359 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 33.5 pt -105.04 177.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 121.466 0.651 . . . . 72.51 112.608 -175.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 94.5 t -77.94 -65.49 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 CA-C-N 115.759 -0.655 . . . . 53.53 110.881 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -157.54 171.7 19.88 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.335 -0.393 . . . . 71.22 111.472 178.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -125.0 166.67 15.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.225 -0.443 . . . . 72.54 110.947 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.7 tttm -153.08 -53.02 0.11 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.655 0.264 . . . . 75.44 110.903 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -147.52 114.08 6.0 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.227 0.537 . . . . 64.12 112.182 174.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.7 p -131.12 78.87 1.86 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.981 -0.554 . . . . 73.51 110.575 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 33.7 p -128.66 -52.06 1.25 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.294 -0.412 . . . . 53.13 111.652 -177.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.636 ' HB3' ' HB3' ' A' ' 50' ' ' SER . 53.1 m-85 61.92 17.39 8.89 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.509 0.559 . . . . 73.42 112.509 175.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 70.22 -112.51 4.39 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 121.022 -0.609 . . . . 41.4 112.835 -177.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -101.4 109.06 20.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.024 0.44 . . . . 74.44 111.501 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.3 mt -84.44 126.29 33.12 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.475 -0.329 . . . . 72.21 110.291 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -127.84 133.47 49.38 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.146 0.498 . . . . 73.14 112.312 -178.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.494 ' HE1' ' HD2' ' A' ' 46' ' ' TYR . 65.7 t80 -77.84 114.75 17.0 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.719 -0.673 . . . . 74.45 111.555 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.7 m -97.39 -62.83 1.2 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 111.875 0.324 . . . . 64.33 111.875 178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.21 171.08 20.85 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.465 0.543 . . . . 72.45 112.465 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -83.2 134.66 34.95 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.936 -0.574 . . . . 75.33 110.847 176.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -86.65 -58.74 2.49 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 120.646 0.26 . . . . 64.4 111.663 -178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 26' ' ' ARG . 31.4 ttm180 -172.65 137.14 0.78 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.115 0.413 . . . . 64.44 112.115 -178.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -94.83 109.06 21.08 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.316 -0.402 . . . . 73.31 110.066 172.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.0 m -77.81 120.74 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 121.12 0.486 . . . . 72.35 111.31 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.454 ' NH1' ' HA ' ' A' ' 39' ' ' ASP . 62.6 mtm180 -104.44 -178.46 3.66 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.403 0.621 . . . . 73.05 112.293 -174.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.507 HG12 ' HE2' ' A' ' 42' ' ' LYS . 52.8 mt -99.42 118.85 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.909 -0.587 . . . . 64.15 111.806 -175.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 53.9 tt0 -85.51 118.19 24.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.055 0.455 . . . . 64.04 110.825 175.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 38' ' ' SER . 1.9 m-20 -74.29 167.54 21.42 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.959 0.725 . . . . 71.34 112.959 -172.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -72.49 -11.38 60.64 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.849 -0.614 . . . . 70.32 111.065 176.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -68.69 -32.02 71.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.281 0.562 . . . . 72.02 110.788 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.09 -33.26 5.11 Favored Glycine 0 CA--C 1.524 0.595 0 CA-C-N 115.859 -0.609 . . . . 64.33 111.952 -174.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.8 p -81.28 158.88 24.63 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.087 0.47 . . . . 64.03 111.27 176.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 38.3 t -93.66 125.02 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 120.712 0.291 . . . . 72.0 111.78 -177.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.448 ' HB2' ' OD1' ' A' ' 32' ' ' ASN . 41.0 t -65.77 152.71 43.7 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.094 0.473 . . . . 73.21 111.407 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.454 ' HA ' ' NH1' ' A' ' 29' ' ' ARG . 6.0 m-20 -77.45 -1.87 32.47 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.154 0.502 . . . . 61.13 111.064 176.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.9 142.48 45.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.137 -0.483 . . . . 73.03 110.682 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.428 ' HA ' ' HA ' ' A' ' 29' ' ' ARG . 62.5 mt -108.27 143.47 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.066 0.46 . . . . 74.45 112.079 -173.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HE2' HG12 ' A' ' 30' ' ' ILE . 69.7 mmtt -88.29 -58.63 2.49 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.072 0.463 . . . . 71.04 110.616 171.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -145.06 171.47 14.44 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.013 -0.539 . . . . 72.44 111.078 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 44' ' ' ARG . 45.7 ttm105 -134.07 114.81 13.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.435 -0.348 . . . . 54.12 111.386 -176.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 55.1 m -97.47 128.41 44.22 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.491 0.552 . . . . 61.33 112.491 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.494 ' HD2' ' HE1' ' A' ' 21' ' ' PHE . 80.1 m-85 -110.68 158.05 19.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.24 0.616 . . . . 74.45 111.365 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -99.94 107.22 19.14 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.525 -0.307 . . . . 73.04 110.484 170.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.9 mt -109.63 121.78 45.98 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.79 0.329 . . . . 72.33 110.849 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -76.05 144.39 40.82 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.07 0.462 . . . . 71.33 111.376 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.636 ' HB3' ' HB3' ' A' ' 16' ' ' PHE . 34.2 m -128.85 152.18 48.8 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.075 -0.511 . . . . 72.51 111.222 -177.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -96.1 -178.92 4.5 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 120.967 0.413 . . . . 72.54 111.542 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -102.42 2.92 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.313 -0.47 . . . . 74.05 112.925 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -68.11 -29.79 68.8 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.042 0.386 . . . . 75.25 112.042 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.45 -3.84 40.12 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.516 -0.373 . . . . 51.14 113.2 -178.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 50' ' ' SER . 11.7 ptm180 -89.94 140.23 29.83 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 122.771 -0.252 . . . . 65.44 110.46 177.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -95.67 -179.55 4.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.978 0.418 . . . . 75.53 111.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.539 HG22 ' CZ2' ' A' ' 98' ' ' TRP . 30.7 pt -126.65 138.11 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 116.266 -0.424 . . . . 74.34 111.194 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -102.46 107.72 18.79 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.717 -0.614 . . . . 73.21 110.86 176.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.629 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 97.9 t -100.38 125.46 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 112.8 0.667 . . . . 63.21 112.8 -172.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -108.05 127.78 54.09 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.039 0.447 . . . . 61.44 111.315 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.415 HD12 ' HB ' ' A' ' 65' ' ' VAL . 37.0 pt -113.58 151.98 45.01 Favored Pre-proline 0 N--CA 1.473 0.675 0 CA-C-N 116.465 -0.334 . . . . 74.14 111.0 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.6 154.4 73.94 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.195 1.93 . . . . 72.42 112.766 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.58 -18.81 8.33 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.363 0.505 . . . . 75.41 112.363 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.2 m -60.89 -19.67 60.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.795 0.438 . . . . 72.22 111.998 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 24.2 t -114.48 120.02 38.77 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 116.666 -0.243 . . . . 62.35 110.893 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 65' ' ' VAL . 16.7 Cg_exo -68.49 -172.43 0.45 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.033 2.489 . . . . 74.0 113.799 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 60.6 tp -72.1 147.41 46.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.049 -0.523 . . . . 75.5 111.092 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.475 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.9 mptp? -94.89 111.82 23.58 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.028 0.442 . . . . 54.22 111.388 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -80.74 65.03 5.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.205 0.526 . . . . 53.14 111.061 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -98.22 166.85 11.2 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.636 0.731 . . . . 70.31 112.304 -177.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.467 ' HB3' ' HB2' ' A' ' 74' ' ' ALA . 24.8 t70 -74.53 149.05 40.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.299 -0.864 . . . . 71.24 111.462 178.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -63.2 122.62 16.59 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.023 0.439 . . . . 65.15 111.642 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 64.07 30.23 13.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.1 0.56 . . . . 73.13 111.89 -177.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 71' ' ' ASP . . . -80.59 151.33 29.14 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.719 0.295 . . . . 31.33 111.352 175.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -66.96 125.1 24.89 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.639 -0.255 . . . . 73.35 111.473 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.61 152.33 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 121.14 0.495 . . . . 64.44 112.007 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -137.69 169.52 17.64 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.858 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD2' HG12 ' A' ' 105' ' ' ILE . 86.5 mt -107.79 155.02 20.69 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.714 0.769 . . . . 72.34 113.053 -174.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.463 HG22 HD22 ' A' ' 80' ' ' ASN . 40.5 mm -111.2 116.28 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 115.156 -0.929 . . . . 61.51 109.522 173.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.463 HD22 HG22 ' A' ' 79' ' ' ILE . 53.1 m-80 53.84 75.46 0.62 Allowed Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 122.645 0.378 . . . . 74.0 111.917 -173.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.58 130.82 7.07 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.68 2.253 . . . . 55.54 114.104 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 101' ' ' LYS . 48.7 pt -132.68 161.01 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 116.355 -0.384 . . . . 73.42 110.909 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -102.85 140.52 37.01 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.806 -0.558 . . . . 54.31 111.303 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -81.0 162.17 23.94 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 120.952 0.406 . . . . 74.31 110.989 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.434 ' HB ' ' HA ' ' A' ' 4' ' ' LEU . 16.5 m -117.88 1.35 12.08 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.109 0.411 . . . . 72.35 112.109 -176.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 4' ' ' LEU . 32.2 m -78.13 -175.27 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 O-C-N 121.909 -0.495 . . . . 64.43 111.581 177.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 67.65 7.52 5.72 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.085 0.469 . . . . 52.43 111.823 -179.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.3 t -89.42 10.49 22.39 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.211 0.529 . . . . 72.54 111.06 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.86 94.33 8.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.054 -0.521 . . . . 65.15 111.704 -178.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 95.1 m 76.12 -23.76 0.23 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.312 0.856 . . . . 73.11 113.312 172.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -67.94 157.66 34.52 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.276 0.56 . . . . 72.11 112.509 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -75.66 143.91 41.94 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.036 -0.529 . . . . 64.23 112.094 -178.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 94' ' ' ALA . . . -72.85 65.65 1.46 Allowed Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.459 -0.337 . . . . 51.52 113.183 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 93' ' ' GLY . . . 169.96 -26.36 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.388 0.675 . . . . 61.51 110.799 -176.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.89 -33.58 64.08 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.909 0.707 . . . . 72.42 112.909 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 59.1 t -78.11 127.44 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 112.47 0.544 . . . . 72.23 112.47 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.04 122.92 18.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.586 -0.524 . . . . 75.33 109.586 170.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.539 ' CZ2' HG22 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -70.83 129.24 38.56 Favored 'General case' 0 C--O 1.249 1.047 0 CA-C-O 122.538 1.161 . . . . 74.3 114.027 -168.069 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -95.72 113.02 24.62 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.031 -1.441 . . . . 75.42 111.512 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 9.9 mt -96.11 165.46 2.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.544 -0.909 . . . . 73.51 108.544 172.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HB2' HG13 ' A' ' 82' ' ' ILE . 28.5 mtpt -140.27 163.84 31.69 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.567 -0.708 . . . . 70.13 110.762 -176.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -154.34 156.01 36.13 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.054 0.454 . . . . 62.13 111.87 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -74.94 -21.96 58.87 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.061 -0.518 . . . . 73.52 110.29 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -171.24 160.88 6.41 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.168 0.509 . . . . 54.21 111.482 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.475 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 38.5 mt -127.34 123.59 62.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.154 -0.475 . . . . 65.24 110.814 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.3 m -128.75 -179.43 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 122.411 0.284 . . . . 73.4 111.125 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 98.0 mt -78.41 144.17 36.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.757 0.313 . . . . 71.41 111.142 176.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.42 HG22 ' HG2' ' A' ' 110' ' ' GLU . 25.7 m -63.31 118.76 8.47 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.924 0.392 . . . . 61.41 111.407 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 71.8 mt -80.66 69.47 7.18 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.129 0.49 . . . . 62.24 111.981 -177.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.42 ' HG2' HG22 ' A' ' 108' ' ' THR . 63.2 mm-40 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 118.901 -0.571 . . . . 70.24 110.658 176.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 120.905 0.384 . . . . 65.21 111.5 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -73.38 124.96 26.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.967 0.413 . . . . 71.53 111.2 176.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.547 ' HD2' ' O ' ' A' ' 4' ' ' LEU . 6.4 tmm_? -95.32 112.24 23.98 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.902 0.382 . . . . 74.5 110.394 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.547 ' O ' ' HD2' ' A' ' 3' ' ' ARG . 2.8 mm? -80.4 -177.19 6.06 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.975 0.417 . . . . 71.2 111.937 -177.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.69 177.5 2.02 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.807 0.669 . . . . 65.14 112.807 -177.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -73.62 169.22 17.72 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.862 -0.608 . . . . 73.33 112.013 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.12 -60.2 4.71 Favored Glycine 0 CA--C 1.525 0.689 0 CA-C-N 116.172 -0.467 . . . . 51.1 113.482 177.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.3 pt -72.92 155.36 7.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 121.143 0.497 . . . . 74.34 111.933 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.1 t -81.63 136.58 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 116.171 -0.468 . . . . 75.34 111.358 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.503 HD22 ' H ' ' A' ' 4' ' ' LEU . 72.0 mt -74.94 160.66 30.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.762 0.315 . . . . 64.2 111.141 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -62.32 110.68 1.72 Allowed 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.213 0.53 . . . . 70.43 111.909 -175.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -135.32 109.07 8.04 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.658 -0.701 . . . . 54.31 110.633 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 57.48 99.29 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.473 0.545 . . . . 63.35 112.473 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.1 p -101.91 108.83 20.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.088 0.471 . . . . 64.22 111.803 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.3 p -107.57 160.39 15.71 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.137 -0.483 . . . . 63.32 110.939 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -80.66 106.33 12.59 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.73 0.3 . . . . 73.11 110.996 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.71 -99.63 1.08 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.346 -0.454 . . . . 23.41 113.507 -178.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.551 ' HG2' HG21 ' A' ' 108' ' ' THR . 51.5 mt-10 -104.0 121.12 42.51 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.542 -0.387 . . . . 64.13 111.49 -178.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -100.06 157.03 16.84 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.495 -0.32 . . . . 75.21 110.303 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -123.23 114.73 20.65 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.844 -0.535 . . . . 74.33 111.607 -178.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -63.75 132.12 49.99 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.258 0.466 . . . . 71.12 112.258 -176.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.9 t -109.15 -65.01 1.18 Allowed 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.131 0.419 . . . . 73.33 112.131 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.49 173.68 15.21 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.117 0.484 . . . . 63.21 112.06 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.2 tp -88.37 117.28 27.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.318 -0.401 . . . . 74.25 110.411 173.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -72.69 -62.38 1.47 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.969 0.414 . . . . 74.13 112.026 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -170.1 143.7 2.52 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.058 -0.519 . . . . 64.11 111.562 -175.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 43.0 mt-10 -105.23 103.66 13.24 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.375 -0.602 . . . . 65.51 109.375 170.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.537 HG23 ' HB2' ' A' ' 42' ' ' LYS . 15.9 m -67.25 102.03 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.587 0.708 . . . . 71.1 110.876 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.755 ' HG2' HG12 ' A' ' 41' ' ' ILE . 98.9 mtt180 -98.52 158.31 15.68 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.719 0.637 . . . . 70.01 112.719 -171.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.5 mt -69.02 109.3 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.586 -0.733 . . . . 70.2 112.076 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' VAL . 63.0 tt0 -86.85 124.52 33.17 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.904 0.383 . . . . 73.11 110.332 174.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -70.43 155.44 40.69 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.795 0.331 . . . . 73.41 111.728 -178.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -23.71 62.72 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.407 0.623 . . . . 74.31 110.666 169.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.1 -28.06 64.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.652 -0.704 . . . . 71.04 111.499 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 112.81 -36.6 4.02 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 116.26 -0.427 . . . . 50.32 112.456 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.3 p -71.33 150.64 44.92 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.147 0.499 . . . . 50.2 111.817 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 22.8 t -92.37 145.92 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.158 -0.474 . . . . 65.32 111.078 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.2 t -101.7 163.4 12.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.111 0.482 . . . . 62.43 111.835 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -77.54 -18.1 57.3 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.986 -0.552 . . . . 64.23 111.141 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.72 132.1 45.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.279 -0.419 . . . . 73.04 110.086 173.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.755 HG12 ' HG2' ' A' ' 29' ' ' ARG . 26.2 mt -109.84 147.47 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 112.069 0.396 . . . . 52.11 112.069 -169.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.537 ' HB2' HG23 ' A' ' 28' ' ' VAL . 39.7 mmtm -74.56 -61.06 2.0 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.416 -0.587 . . . . 61.14 109.416 169.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -155.26 167.23 31.05 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.384 -0.825 . . . . 63.35 110.022 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.462 ' HD3' ' OH ' ' A' ' 46' ' ' TYR . 4.3 ptp85 -122.7 133.72 54.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.161 0.505 . . . . 73.32 112.157 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.5 m -107.52 124.93 50.63 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.858 -0.61 . . . . 74.15 112.474 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.462 ' OH ' ' HD3' ' A' ' 44' ' ' ARG . 79.7 m-85 -110.81 153.66 25.05 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 122.88 0.472 . . . . 74.24 111.143 176.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -97.64 114.33 26.25 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.324 -0.398 . . . . 72.13 111.06 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.543 HD12 HG21 ' A' ' 59' ' ' VAL . 47.4 mt -114.21 132.34 56.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.569 0.7 . . . . 73.5 111.77 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HB3' ' NZ ' ' A' ' 49' ' ' LYS . 2.6 mmmp? -93.28 150.99 20.07 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.557 -0.747 . . . . 73.2 111.16 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.424 ' HB3' HE22 ' A' ' 53' ' ' GLN . 64.2 m -115.6 120.2 38.65 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.871 0.367 . . . . 70.04 111.802 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -73.47 121.33 20.38 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.089 -0.505 . . . . 71.43 110.753 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.49 -102.9 0.65 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 121.085 -0.579 . . . . 72.14 113.825 177.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 55' ' ' ARG . 5.5 pm0 -64.2 -11.52 31.74 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.114 0.783 . . . . 75.23 113.114 -175.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.83 16.59 72.36 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.728 -0.749 . . . . 70.24 114.316 175.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HB2' HE21 ' A' ' 53' ' ' GLN . 36.9 mtt180 -78.89 161.95 26.37 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 117.455 0.628 . . . . 75.22 111.119 174.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.9 ttt -128.43 148.63 50.72 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.975 -0.557 . . . . 65.11 110.763 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 pt -135.48 135.44 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.918 0.389 . . . . 73.35 111.28 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -98.11 105.73 17.92 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.109 0.48 . . . . 52.41 110.494 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.543 HG21 HD12 ' A' ' 48' ' ' LEU . 70.1 t -94.41 129.98 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.343 -0.389 . . . . 73.33 111.715 -174.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.5 ' O ' ' HA ' ' A' ' 101' ' ' LYS . 39.9 m -118.38 141.82 48.15 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.944 0.402 . . . . 73.55 111.292 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 29.1 pt -131.24 150.97 78.0 Favored Pre-proline 0 CA--C 1.539 0.525 0 O-C-N 122.305 -0.247 . . . . 72.3 110.928 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.471 ' HG2' HG23 ' A' ' 65' ' ' VAL . 12.2 Cg_endo -55.76 146.13 68.09 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.481 2.12 . . . . 73.2 112.974 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.49 -28.49 59.94 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.678 0.621 . . . . 43.25 112.678 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.0 m -62.23 -26.5 68.41 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.079 0.4 . . . . 63.41 112.079 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.471 HG23 ' HG2' ' A' ' 62' ' ' PRO . 51.0 t -79.01 125.05 84.48 Favored Pre-proline 0 CA--C 1.544 0.723 0 CA-C-N 116.841 -0.163 . . . . 52.0 110.996 179.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -64.73 161.35 36.3 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.408 . . . . 73.2 114.416 -174.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 43.7 tp -67.61 138.16 56.19 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.835 -0.621 . . . . 73.04 111.224 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HE3' ' HB ' ' A' ' 105' ' ' ILE . 4.4 mptp? -81.84 -48.98 10.89 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.266 0.839 . . . . 74.42 113.266 -173.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 63.77 21.59 12.73 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.834 0.679 . . . . 73.13 112.834 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -64.66 159.5 21.9 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.009 0.433 . . . . 61.22 111.865 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 4.9 m-20 -68.06 154.22 42.1 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.409 0.623 . . . . 72.11 112.512 -177.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -65.02 133.53 51.88 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.718 -0.673 . . . . 73.04 111.178 174.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 63.3 19.54 11.74 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.189 0.596 . . . . 73.1 112.481 -177.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 71' ' ' ASP . . . -82.22 153.65 25.82 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.156 0.428 . . . . 50.21 112.156 178.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.529 ' HB3' ' HB ' ' A' ' 108' ' ' THR . 65.4 mtt85 -70.77 104.35 2.86 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.954 -0.566 . . . . 33.21 112.111 179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.443 HG12 HD23 ' A' ' 107' ' ' LEU . 31.8 m -120.13 153.06 23.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.099 -0.5 . . . . 75.13 111.273 177.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -145.92 173.49 12.1 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.131 0.491 . . . . 73.44 111.064 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HG11 ' A' ' 59' ' ' VAL . 81.8 mt -112.18 132.17 55.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.061 0.457 . . . . 52.33 111.981 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.599 HG22 ' ND2' ' A' ' 80' ' ' ASN . 48.5 mm -65.04 -59.54 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 115.916 -0.584 . . . . 64.23 111.337 178.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.599 ' ND2' HG22 ' A' ' 79' ' ' ILE . 47.5 m-80 -130.41 87.41 50.53 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 122.388 -0.195 . . . . 75.42 110.936 174.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.34 140.4 10.87 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 123.219 2.612 . . . . 64.22 114.509 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.8 pt -136.11 149.57 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-O 120.828 0.347 . . . . 54.13 110.858 172.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -90.35 117.36 29.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.579 0.228 . . . . 64.54 111.097 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.59 141.59 41.9 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.527 0.936 . . . . 72.53 113.527 -173.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.9 t -130.83 20.33 5.03 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.834 -1.076 . . . . 74.23 109.512 170.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.1 m -75.48 9.42 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 N-CA-C 113.226 0.824 . . . . 70.03 113.226 -173.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.542 ' HB1' ' HB2' ' A' ' 91' ' ' TYR . . . -79.27 53.85 1.57 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.404 0.621 . . . . 74.34 111.031 177.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.7 p -79.79 -18.39 51.1 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.908 -0.587 . . . . 75.1 112.326 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -89.54 92.85 9.27 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.887 0.375 . . . . 70.52 111.655 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.5 m 80.3 -29.99 0.13 Allowed 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.645 0.778 . . . . 62.12 113.038 174.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.542 ' HB2' ' HB1' ' A' ' 87' ' ' ALA . 97.0 m-85 -80.11 19.27 0.74 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.341 0.867 . . . . 75.02 113.341 -175.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -53.89 137.12 39.56 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.928 0.394 . . . . 43.12 111.458 176.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 105.74 62.92 0.62 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 121.229 -0.51 . . . . 73.54 113.287 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -124.5 76.57 1.5 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.189 0.519 . . . . 74.43 111.235 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -86.89 110.65 20.13 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.156 -0.475 . . . . 62.3 111.012 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 96.5 t 70.98 -51.58 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 123.429 0.692 . . . . 62.55 112.217 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -58.99 104.68 0.25 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.939 -0.393 . . . . 74.34 109.939 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -133.43 165.01 25.86 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.537 0.94 . . . . 73.21 113.537 -166.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.03 148.41 41.51 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.954 -1.021 . . . . 71.44 111.64 -178.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 59' ' ' VAL . 65.1 mt -129.01 115.04 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-N 116.106 -0.497 . . . . 52.32 110.24 177.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 60' ' ' SER . 45.7 mtpt -89.98 136.14 33.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.33 0.586 . . . . 64.31 111.813 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.13 153.29 43.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.339 0.59 . . . . 71.43 112.068 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 80' ' ' ASN . 33.6 t70 -63.94 -40.66 96.95 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.309 0.576 . . . . 72.14 111.028 173.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -165.22 158.49 16.5 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.742 -0.663 . . . . 72.53 111.112 179.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.445 ' HB ' ' HE3' ' A' ' 68' ' ' LYS . 39.2 mt -119.01 123.23 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.136 -0.484 . . . . 53.14 111.25 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 36.0 m -128.12 -179.8 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-O 120.781 0.324 . . . . 64.13 111.75 -178.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.443 HD23 HG12 ' A' ' 76' ' ' VAL . 87.5 mt -91.58 138.16 31.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 73.41 111.435 177.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.551 HG21 ' HG2' ' A' ' 18' ' ' GLU . 8.3 m -75.71 153.72 36.9 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.046 -0.525 . . . . 53.24 111.452 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt 64.85 33.15 10.32 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.705 0.631 . . . . 61.21 112.705 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 . . . . . 0 C--O 1.255 1.346 0 CA-C-O 118.94 -0.552 . . . . 72.15 110.716 174.433 . . . . . . . . 0 0 . 1 stop_ 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