data_2bic_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 2bic _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 ' 4' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 121.643 0.735 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -126.47 165.7 18.62 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 122.211 1.005 . . . . 0.0 109.736 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.4 t -78.89 145.73 33.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.139 0.971 . . . . 0.0 112.891 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -141.01 75.87 1.52 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 169.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.42 -171.82 2.75 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.567 0.699 . . . . 0.0 110.879 -175.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.8 mm -73.32 -64.25 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.586 -0.696 . . . . 0.0 111.01 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.54 -58.91 3.7 Favored Glycine 0 N--CA 1.469 0.869 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.471 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -39.44 155.61 0.15 Allowed Pre-proline 0 N--CA 1.476 0.859 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.35 147.15 12.52 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.274 1.982 . . . . 0.0 114.928 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -67.19 162.36 22.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.683 0.754 . . . . 0.0 111.476 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.9 tp -55.24 -46.48 76.01 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -169.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -102.02 42.38 1.14 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.534 -175.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.7 p -106.8 158.56 16.9 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.386 -0.821 . . . . 0.0 110.124 175.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -63.64 -39.91 95.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.435 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.47 69.95 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.0 -39.57 94.41 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.2 -39.2 74.91 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.505 -0.747 . . . . 0.0 112.544 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.26 -50.53 60.12 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.58 -0.7 . . . . 0.0 112.633 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -73.18 -39.24 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.6 p -71.42 -31.86 67.72 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -66.12 -32.43 73.88 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.538 -0.726 . . . . 0.0 112.574 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -63.08 -45.73 90.72 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.596 -0.69 . . . . 0.0 111.776 174.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.9 m -69.93 -35.53 74.6 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.75 -40.43 97.24 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.578 -0.701 . . . . 0.0 112.261 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.36 -37.99 89.46 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -76.13 126.31 30.76 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.958 0.885 . . . . 0.0 110.521 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.24 -134.93 17.7 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.738 179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -165.49 -67.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -154.27 105.42 2.69 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.99 -114.51 0.45 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.146 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.4 -55.01 4.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.757 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -18.67 -67.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -38.69 -40.67 0.63 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 -170.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -72.56 -51.27 20.56 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.236 -0.915 . . . . 0.0 111.951 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -72.03 -25.6 61.87 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.5 t -84.75 -24.16 28.93 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 171.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.6 t -85.92 -23.74 26.86 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 170.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -84.93 -33.62 22.66 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 118.726 -1.19 . . . . 0.0 112.384 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.45 -50.88 19.38 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.967 -1.083 . . . . 0.0 111.143 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -98.7 92.41 5.57 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 167.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.468 0.464 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.926 -173.339 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -90.13 142.39 27.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.106 0.955 . . . . 0.0 111.148 -170.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.523 ' H ' ' HB3' ' A' ' 23' ' ' SER . 4.3 t -67.45 109.08 3.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.414 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -134.39 78.52 1.76 Allowed 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 175.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.465 ' HB1' ' SG ' ' A' ' 40' ' ' CYS . . . -81.49 -102.54 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.894 -176.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.61 107.8 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 119.673 -0.811 . . . . 0.0 108.83 169.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.04 -49.61 1.14 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 120.124 -1.036 . . . . 0.0 113.122 176.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 m -27.37 145.28 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 116.893 2.182 . . . . 0.0 116.893 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -48.63 163.99 0.24 Allowed 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.667 2.245 . . . . 0.0 116.887 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.6 m -57.08 145.49 30.68 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.862 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 mp -53.02 -51.46 61.62 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -98.04 75.12 2.32 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.845 0.831 . . . . 0.0 110.192 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.7 p -148.27 165.98 29.36 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.583 0.706 . . . . 0.0 109.615 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -65.16 -35.31 80.71 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -46.13 67.43 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.406 -0.809 . . . . 0.0 111.971 177.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.13 -29.72 70.59 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -57.63 -47.51 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.686 -0.634 . . . . 0.0 112.286 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.55 -62.57 1.39 Allowed 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.445 -0.785 . . . . 0.0 111.083 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -53.37 -28.8 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.523 ' HB3' ' H ' ' A' ' 6' ' ' CYS . 89.6 p -86.51 -29.84 22.42 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -62.68 -25.99 68.43 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.953 -1.092 . . . . 0.0 113.15 171.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -85.86 -43.82 12.95 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.926 168.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.66 -41.77 95.86 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.974 1.261 . . . . 0.0 112.645 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 tpt180 -64.73 -26.5 68.39 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -84.42 -31.48 24.62 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.609 168.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -78.93 -166.05 0.84 Allowed 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.348 -0.845 . . . . 0.0 109.09 169.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.98 -126.42 13.66 Favored Glycine 0 N--CA 1.469 0.868 0 C-N-CA 119.877 -1.154 . . . . 0.0 112.371 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -157.92 -81.66 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.942 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -157.79 -53.89 0.07 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.37 -173.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.78 -109.29 3.03 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 120.203 -0.999 . . . . 0.0 111.651 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -93.18 30.88 1.55 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -86.72 -16.11 37.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.338 -0.852 . . . . 0.0 112.367 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -69.85 -15.03 63.03 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -33.01 -52.78 0.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -172.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 48.3 mtm105 -64.18 -61.78 2.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.678 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 21.0 t -40.97 -47.77 3.07 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.465 ' SG ' ' HB1' ' A' ' 8' ' ' ALA . 46.6 t -76.26 -36.81 58.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -71.53 -47.39 55.52 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.598 -0.689 . . . . 0.0 111.406 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -71.16 -43.96 66.48 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.794 -0.566 . . . . 0.0 111.977 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -98.72 86.13 3.47 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 N--CA 1.469 0.492 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.76 -177.71 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -90.64 77.58 6.35 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.392 0.615 . . . . 0.0 109.574 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -28.82 112.73 0.07 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 -171.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -117.99 83.73 2.05 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.893 0.854 . . . . 0.0 109.504 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.87 169.2 18.4 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.746 0.784 . . . . 0.0 111.13 175.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -71.86 105.82 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 122.11 0.957 . . . . 0.0 110.302 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.87 -80.39 0.29 Allowed Glycine 0 N--CA 1.468 0.798 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -173.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -33.41 153.66 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.868 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 -175.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -44.21 141.38 4.88 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.812 2.341 . . . . 0.0 116.592 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.6 t -86.97 177.8 7.13 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.256 -176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.0 tp -54.49 -40.37 68.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -82.06 81.65 7.93 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.463 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.5 p 168.38 138.96 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 166.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -65.33 -20.74 66.53 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.3 -33.57 73.79 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.326 -0.859 . . . . 0.0 113.039 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -70.96 -40.04 72.2 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.725 173.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.09 -35.87 74.15 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 177.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.72 66.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.624 -0.672 . . . . 0.0 112.684 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.2 p -70.91 -36.59 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 O-C-N 121.671 -0.643 . . . . 0.0 112.715 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.0 p -67.93 -37.99 82.33 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.608 -0.683 . . . . 0.0 112.618 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -59.77 -35.97 75.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -65.45 -45.59 83.18 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.705 -0.622 . . . . 0.0 112.148 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.1 m -72.47 -38.13 68.3 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.659 -0.651 . . . . 0.0 112.582 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -65.91 -26.86 67.8 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.63 -39.03 49.33 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -71.91 -57.66 4.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.743 170.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.3 74.87 1.25 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 120.171 -1.014 . . . . 0.0 112.079 173.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -102.56 148.14 25.92 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.631 0.729 . . . . 0.0 110.046 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.8 mt -126.75 86.1 2.47 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 174.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 157.78 -83.42 0.14 Allowed Glycine 0 CA--C 1.526 0.763 0 C-N-CA 119.759 -1.21 . . . . 0.0 111.621 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 28.2 t70 -142.92 129.73 20.46 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 32.7 t70 172.87 -56.89 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 169.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -32.93 -49.53 0.24 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -33.86 -58.05 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -66.52 -60.2 2.95 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.52 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -36.72 -46.31 0.59 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 m -73.54 -45.71 51.98 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -67.25 -29.9 69.65 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.09 -50.24 62.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.43 -0.794 . . . . 0.0 111.646 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -87.46 72.64 9.67 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.009 0.909 . . . . 0.0 109.028 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.469 0.502 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -175.367 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -115.05 77.15 1.04 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.126 -174.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -26.37 120.79 0.08 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.882 2.179 . . . . 0.0 116.882 -172.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -94.13 79.67 4.04 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.862 0.839 . . . . 0.0 109.494 178.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -87.44 151.44 23.05 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.651 0.739 . . . . 0.0 110.826 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.72 110.32 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.884 0.85 . . . . 0.0 109.063 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.94 -48.36 0.95 Allowed Glycine 0 CA--C 1.528 0.863 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.169 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.616 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 16.2 t -64.87 150.13 95.31 Favored Pre-proline 0 CA--C 1.542 0.641 0 O-C-N 122.213 -0.581 . . . . 0.0 111.65 -175.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.616 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 92.5 Cg_exo -57.99 174.43 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 121.926 1.751 . . . . 0.0 115.696 -174.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -63.12 167.26 5.12 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.986 0.898 . . . . 0.0 112.849 -174.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 74.6 mt -52.96 -53.65 46.56 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -173.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -97.61 90.49 5.03 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.847 0.832 . . . . 0.0 109.063 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -148.38 176.49 10.23 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.942 0.877 . . . . 0.0 109.956 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -68.15 -45.34 73.81 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.465 -0.772 . . . . 0.0 112.413 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.61 -62.12 1.51 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.927 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -40.57 -48.72 2.9 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.581 1.696 . . . . 0.0 115.581 -172.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.71 -45.71 77.82 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.48 71.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.707 -0.62 . . . . 0.0 112.649 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.1 m -68.5 -35.47 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -70.04 -33.54 72.1 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.735 -0.603 . . . . 0.0 112.578 176.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -65.13 -38.61 91.2 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.635 -0.666 . . . . 0.0 112.241 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.99 -44.69 97.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.921 -0.487 . . . . 0.0 112.161 174.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.0 m -72.67 -32.9 66.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.2 tpt85 -69.51 -37.54 77.21 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.68 -32.83 74.44 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -142.87 81.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.93 0.871 . . . . 0.0 109.028 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.28 36.16 0.02 OUTLIER Glycine 0 CA--C 1.529 0.96 0 C-N-CA 119.854 -1.165 . . . . 0.0 113.138 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -83.55 94.52 8.08 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.83 0.824 . . . . 0.0 109.906 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.09 -44.28 0.57 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.866 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.6 44.92 1.48 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.45 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -170.74 -46.59 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -29.81 70.85 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -59.63 -33.34 71.38 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -65.44 -54.77 23.66 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.593 -0.692 . . . . 0.0 111.419 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -71.12 -32.73 69.37 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.5 t -67.05 -44.73 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -176.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 m -66.18 -37.57 85.93 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -53.32 -52.38 59.34 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.843 0.747 . . . . 0.0 112.263 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -29.69 -54.7 0.16 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -99.51 -34.87 10.08 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.446 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.9 t . . . . . 0 N--CA 1.471 0.606 0 O-C-N 121.354 -0.841 . . . . 0.0 113.227 -175.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -104.81 156.4 18.04 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.93 0.871 . . . . 0.0 110.355 -174.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.406 ' H ' ' HB2' ' A' ' 23' ' ' SER . 9.3 t -85.46 131.82 34.32 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.38 0.609 . . . . 0.0 111.145 -176.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -133.8 78.01 1.74 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.12 -160.12 0.64 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.435 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.27 100.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 169.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.08 -53.98 0.5 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.796 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.655 ' SG ' ' CD ' ' A' ' 12' ' ' PRO . 4.0 t -74.07 167.19 37.9 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 122.456 -0.437 . . . . 0.0 109.988 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.655 ' CD ' ' SG ' ' A' ' 11' ' ' CYS . 71.5 Cg_exo -66.12 175.23 4.98 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.402 1.401 . . . . 0.0 114.739 -169.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.0 m -67.98 142.78 55.86 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.46 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.71 -40.4 72.37 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.8 60.28 5.83 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.762 0.792 . . . . 0.0 110.728 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.9 p -156.53 143.62 18.86 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.08 -23.99 66.84 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -38.31 90.62 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 112.487 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -67.35 -39.94 85.8 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.747 -0.596 . . . . 0.0 112.025 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.81 -37.74 69.04 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.73 -43.98 87.37 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.472 -0.768 . . . . 0.0 112.693 176.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.578 HG12 ' SG ' ' A' ' 11' ' ' CYS . 97.4 t -72.89 -47.1 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.756 -0.59 . . . . 0.0 111.629 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 6' ' ' CYS . 90.9 p -67.85 -24.66 65.29 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -83.93 -22.98 31.34 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 171.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -83.44 -32.11 26.24 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 118.335 -1.346 . . . . 0.0 112.117 168.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -66.34 -41.39 89.65 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 120.968 -1.083 . . . . 0.0 111.789 170.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.8 tpt85 -35.02 -52.53 0.56 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -35.12 -57.87 0.56 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -171.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -90.24 106.11 18.27 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -175.74 92.16 0.09 OUTLIER Glycine 0 N--CA 1.465 0.608 0 C-N-CA 119.181 -1.485 . . . . 0.0 111.57 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -86.28 -61.6 1.71 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.97 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.5 mt -125.02 -62.54 1.22 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.85 80.48 0.08 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -135.99 -53.58 0.75 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.526 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.15 -56.46 6.8 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 120.326 -0.549 . . . . 0.0 111.399 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -29.54 -53.97 0.14 Allowed 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -172.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -39.55 -55.88 1.75 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -172.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.466 ' HG3' ' H ' ' A' ' 39' ' ' CYS . 40.2 ptt180 -65.9 -56.77 10.07 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.189 -0.605 . . . . 0.0 111.057 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.466 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 42.7 t -38.23 -51.62 1.47 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.72 -34.87 52.53 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -77.57 -28.5 51.77 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -178.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -96.81 -94.36 0.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 119.351 -0.94 . . . . 0.0 108.809 170.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -28.78 -64.21 0.1 Allowed 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.589 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 42.6 t . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.6 tp . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.772 0.796 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -120.37 106.44 11.85 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -175.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.4 m -12.79 111.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -137.81 76.42 1.58 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.75 -168.3 1.55 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.763 0.792 . . . . 0.0 111.252 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -74.93 101.5 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.768 0.794 . . . . 0.0 108.971 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.72 40.41 5.31 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.069 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.589 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 19.9 t -117.38 148.73 43.3 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.59 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 84.2 Cg_exo -55.52 170.93 0.73 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.053 1.835 . . . . 0.0 114.732 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -65.71 161.72 20.09 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.523 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 tp -57.33 -59.21 5.47 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -89.62 79.92 6.74 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.386 1.089 . . . . 0.0 110.636 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.7 p -151.96 154.77 36.72 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -60.0 -39.59 86.29 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -41.43 89.92 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -66.15 -48.68 69.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.64 -33.08 72.27 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.273 -0.892 . . . . 0.0 113.148 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -50.31 64.85 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.419 -0.801 . . . . 0.0 112.291 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -74.08 -33.88 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.0 m -69.56 -39.82 77.16 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -65.96 -29.88 70.35 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.57 -47.21 82.46 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.649 -0.657 . . . . 0.0 111.974 176.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.41 -59.96 2.65 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.991 174.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -35.21 -49.23 0.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -58.66 -55.72 31.43 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -170.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -90.04 90.26 8.06 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.174 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 142.67 -35.06 1.75 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.512 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -14.72 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 -169.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.4 mt -143.09 -70.3 0.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.57 -81.01 0.08 OUTLIER Glycine 0 N--CA 1.467 0.722 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -87.01 83.22 7.54 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -158.15 -29.14 0.08 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.809 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -99.67 52.71 0.93 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.517 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -80.1 -49.54 11.6 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.023 172.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -75.71 -39.32 57.56 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.875 -0.516 . . . . 0.0 112.347 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.2 t -61.96 -43.54 98.63 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.532 -0.73 . . . . 0.0 112.914 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.4 m -68.23 -48.44 65.12 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 120.19 -0.604 . . . . 0.0 112.338 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.15 -41.62 73.6 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.05 -24.55 63.27 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -97.72 -96.62 0.21 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 168.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.59 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.8 t . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 -170.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -79.8 120.51 24.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.557 0.694 . . . . 0.0 110.614 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.437 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 30.1 p -81.79 111.68 18.24 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.965 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -92.65 73.1 5.04 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.894 0.854 . . . . 0.0 109.513 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.54 167.02 12.53 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.853 0.835 . . . . 0.0 110.494 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.1 -38.22 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.64 2.67 73.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 120.035 -1.078 . . . . 0.0 114.925 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.532 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.5 t -94.54 155.22 39.81 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 118.649 1.224 . . . . 0.0 110.424 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.573 ' HD3' ' SG ' ' A' ' 44' ' ' CYS . 50.4 Cg_exo -67.21 176.47 4.65 Favored 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 121.542 1.494 . . . . 0.0 113.871 -173.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.7 t -72.59 158.47 35.61 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.882 0.849 . . . . 0.0 111.356 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -61.11 -42.55 98.74 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -70.21 -26.85 64.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -175.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -74.51 148.98 40.46 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.866 0.841 . . . . 0.0 111.329 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.03 -19.49 65.7 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -176.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.88 91.3 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.375 -0.828 . . . . 0.0 112.712 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -68.86 -36.91 78.7 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.658 -0.651 . . . . 0.0 112.002 174.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -62.41 -42.25 99.3 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.679 -0.638 . . . . 0.0 112.226 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.33 -46.11 71.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.419 HG13 ' SG ' ' A' ' 44' ' ' CYS . 7.4 p -68.66 -29.56 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.8 p -64.17 -29.85 70.95 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.8 tptp -66.2 -41.88 89.56 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.578 -0.701 . . . . 0.0 111.761 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -64.23 -44.88 90.49 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 112.05 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.27 -31.13 72.12 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.6 tpt180 -63.18 -41.4 99.21 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.536 -0.727 . . . . 0.0 112.516 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -64.86 -36.85 85.67 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.597 -0.689 . . . . 0.0 112.416 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -81.83 126.15 31.53 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.772 0.796 . . . . 0.0 110.444 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.22 -125.76 8.23 Favored Glycine 0 N--CA 1.467 0.74 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.327 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -163.27 -67.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.402 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.49 -52.43 0.71 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.366 -0.533 . . . . 0.0 110.873 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.49 62.42 0.43 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.909 -1.139 . . . . 0.0 111.644 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -156.9 36.13 0.3 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.654 0.74 . . . . 0.0 111.893 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -161.05 -54.36 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -34.5 -42.32 0.14 Allowed 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -62.75 -57.83 9.58 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.583 -0.447 . . . . 0.0 112.02 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -63.04 -48.12 80.09 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.303 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.3 t -37.78 -59.52 0.81 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.36 -29.69 53.48 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.45 -27.28 69.17 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.939 -1.101 . . . . 0.0 113.811 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -97.08 -53.51 3.47 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.622 169.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -77.04 -45.38 27.34 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.488 -0.758 . . . . 0.0 112.935 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.573 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.0 t . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.938 0.875 . . . . 0.0 111.163 -177.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 43.3 tp . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -87.14 179.39 6.66 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.546 1.165 . . . . 0.0 112.025 -169.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.4 t -113.74 122.97 48.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.049 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -142.94 78.02 1.59 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 122.026 0.917 . . . . 0.0 108.56 174.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.423 ' HB1' ' SG ' ' A' ' 40' ' ' CYS . . . -87.0 -168.35 2.21 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.596 0.712 . . . . 0.0 110.848 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.9 mt -76.5 97.03 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.82 0.819 . . . . 0.0 109.038 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.57 47.74 3.4 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.734 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.578 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.2 t -117.3 150.68 46.8 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.578 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.2 Cg_exo -60.94 175.11 1.43 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 121.708 1.605 . . . . 0.0 114.305 -177.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.7 p -72.39 150.33 43.51 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.665 0.745 . . . . 0.0 110.862 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -12.95 62.15 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -77.25 -33.94 55.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.407 -0.808 . . . . 0.0 111.889 174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.2 p -75.84 153.91 36.5 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.022 0.915 . . . . 0.0 111.44 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -67.57 -27.43 66.92 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -47.11 86.96 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.485 -0.759 . . . . 0.0 113.018 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -70.75 -32.53 69.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.07 -34.54 76.48 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.522 -0.736 . . . . 0.0 112.619 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -35.09 79.98 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.531 -0.731 . . . . 0.0 112.887 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.15 -49.15 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 121.748 -0.595 . . . . 0.0 111.023 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -65.29 -29.8 70.6 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -67.29 -27.92 67.58 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 178.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -86.77 -37.83 17.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 118.827 -1.149 . . . . 0.0 112.496 168.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.1 m -66.63 -61.05 2.18 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.06 -1.025 . . . . 0.0 112.125 -178.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -36.89 -45.72 0.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.8 -29.55 64.97 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -176.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -64.57 -53.99 39.2 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.531 -0.731 . . . . 0.0 111.186 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.57 97.6 1.4 Allowed Glycine 0 N--CA 1.467 0.726 0 C-N-CA 119.966 -1.111 . . . . 0.0 112.094 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -145.16 101.02 3.56 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.73 157.27 18.57 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.908 0.861 . . . . 0.0 110.201 -175.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.71 -74.81 1.31 Allowed Glycine 0 N--CA 1.468 0.806 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -90.02 103.86 16.48 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -65.02 114.76 4.8 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -22.05 81.93 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 -169.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -88.17 -12.2 44.62 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -170.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.01 -62.23 1.62 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 118.323 -1.351 . . . . 0.0 108.188 167.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.7 t -43.4 -42.01 4.47 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.423 ' SG ' ' HB1' ' A' ' 8' ' ' ALA . 48.8 t -64.63 -51.35 63.11 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' CG ' ' H ' ' A' ' 42' ' ' GLU . 13.9 pt-20 -68.98 -58.18 4.46 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.581 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.408 ' H ' ' CG ' ' A' ' 41' ' ' GLU . 9.5 tp10 -31.69 -67.92 0.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -91.51 52.73 2.12 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.277 0.561 . . . . 0.0 111.579 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.425 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.3 t . . . . . 0 N--CA 1.469 0.52 0 O-C-N 121.28 -0.888 . . . . 0.0 110.241 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.9 tt . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -98.4 172.17 7.71 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.512 0.673 . . . . 0.0 109.726 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 4.3 t -115.04 114.61 25.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.161 169.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -100.59 75.63 1.76 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.68 0.752 . . . . 0.0 110.44 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -107.21 153.8 22.16 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.575 0.702 . . . . 0.0 109.509 172.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.2 tp -68.08 -39.95 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.63 31.69 6.0 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.499 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.719 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 2.2 t -117.61 152.21 49.38 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.719 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 49.9 Cg_endo -71.19 -175.48 1.52 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.592 1.528 . . . . 0.0 112.882 -174.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -58.83 149.03 27.83 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.767 0.794 . . . . 0.0 112.563 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.5 mt -59.32 -47.02 86.97 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.643 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -85.04 96.06 9.29 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.393 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 p 169.82 162.32 0.06 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 166.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -61.68 -32.85 73.06 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -172.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.13 81.77 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.546 -0.722 . . . . 0.0 112.565 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -67.78 -40.22 83.99 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.654 -0.654 . . . . 0.0 112.442 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.23 -38.97 88.55 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.92 94.56 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.1 t -68.97 -45.42 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 O-C-N 121.771 -0.581 . . . . 0.0 111.377 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.3 p -63.02 -41.59 99.59 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -73.75 -30.93 63.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.57 -51.11 46.23 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.742 -0.599 . . . . 0.0 111.734 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.1 t -76.73 -28.62 55.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.718 -0.793 . . . . 0.0 113.021 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.52 -41.13 84.78 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.621 -0.674 . . . . 0.0 112.271 170.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -63.11 -36.28 83.07 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.74 -0.6 . . . . 0.0 112.523 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -69.87 -54.61 12.67 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.791 -0.568 . . . . 0.0 111.312 176.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' A' ' 31' ' ' LYS . . . -94.81 -109.36 2.24 Favored Glycine 0 N--CA 1.468 0.807 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 57.6 tptt 169.52 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 167.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.5 mt -124.12 127.4 47.74 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.11 -147.91 14.08 Favored Glycine 0 CA--C 1.526 0.753 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.607 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.7 -35.38 65.15 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.229 -0.571 . . . . 0.0 112.513 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -18.37 -56.94 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.544 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 82.1 m-85 -58.86 -25.48 63.33 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -169.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -66.85 -57.58 6.72 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.121 -0.987 . . . . 0.0 111.4 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -68.99 -60.02 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.225 175.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.9 t -48.6 -29.38 4.23 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -172.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.8 m -87.08 -45.74 10.43 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 119.029 -1.069 . . . . 0.0 112.683 170.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.37 -41.31 51.66 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -178.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.44 -56.3 4.65 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.63 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -91.78 67.82 5.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.392 -0.818 . . . . 0.0 111.649 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 46.1 t . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 122.001 0.905 . . . . 0.0 109.968 175.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tt . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -80.57 94.2 6.23 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.772 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.2 t -25.32 120.33 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 117.09 2.255 . . . . 0.0 117.09 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -88.48 79.35 7.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.921 0.867 . . . . 0.0 109.749 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.11 162.09 13.69 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 122.034 0.921 . . . . 0.0 111.038 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -76.2 -66.85 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.093 -176.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.84 60.56 0.46 Allowed Glycine 0 N--CA 1.469 0.882 0 C-N-CA 120.151 -1.023 . . . . 0.0 111.872 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.652 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 13.9 t -117.46 154.77 50.61 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.652 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.9 Cg_exo -58.86 -176.16 0.09 OUTLIER 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.969 1.779 . . . . 0.0 115.464 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.2 m -57.77 144.63 37.68 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.658 0.742 . . . . 0.0 111.636 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.04 -56.5 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.408 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -91.36 68.83 5.91 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.301 1.048 . . . . 0.0 110.71 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.6 p -139.59 160.72 39.21 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.521 0.677 . . . . 0.0 109.254 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.31 -31.42 71.26 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.25 -54.63 9.02 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.58 -0.7 . . . . 0.0 112.004 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -68.95 -29.86 68.18 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -61.86 -39.46 91.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.414 -0.804 . . . . 0.0 112.216 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.19 -36.0 81.94 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 173.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.4 t -63.01 -48.68 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.821 -0.549 . . . . 0.0 111.132 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.8 m -64.79 -29.06 70.02 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 177.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -61.84 -54.2 45.43 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.7 -0.625 . . . . 0.0 112.112 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -73.5 -63.88 1.1 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.924 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.5 m -38.84 -43.08 0.9 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 116.925 2.194 . . . . 0.0 116.925 -174.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -48.1 -29.01 3.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -57.16 -31.89 65.85 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -177.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -132.88 121.38 22.8 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.603 -0.686 . . . . 0.0 109.591 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.24 22.09 2.18 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 120.626 -0.797 . . . . 0.0 114.612 175.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -17.72 -72.35 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -172.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.12 165.34 28.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.865 0.84 . . . . 0.0 110.62 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.44 -80.04 1.29 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 120.182 -1.009 . . . . 0.0 110.674 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.11 86.63 4.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.81 118.3 10.13 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -29.17 84.37 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -94.76 -15.05 24.14 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.681 -1.145 . . . . 0.0 114.073 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -87.23 -33.4 19.32 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 118.833 -1.147 . . . . 0.0 112.465 169.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.82 -47.25 85.45 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.377 -0.827 . . . . 0.0 112.606 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.8 m -77.45 -43.6 31.84 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -68.12 -39.77 82.66 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.586 -0.696 . . . . 0.0 112.774 -177.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -71.77 -45.83 60.34 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.662 -0.649 . . . . 0.0 112.352 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -79.47 -77.51 0.18 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.434 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.494 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 49.4 t . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -170.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.2 tp . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -78.66 156.64 28.91 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.07 0.938 . . . . 0.0 110.804 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' HG11 ' A' ' 22' ' ' VAL . 4.7 m -67.79 139.64 56.62 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.018 0.913 . . . . 0.0 111.77 178.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -149.4 77.97 1.36 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 173.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.14 -179.35 5.06 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.8 0.81 . . . . 0.0 110.908 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.2 tt -65.06 -38.05 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.38 46.96 1.04 Allowed Glycine 0 CA--C 1.529 0.946 0 C-N-CA 120.239 -0.981 . . . . 0.0 112.003 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 48.5 t -117.27 145.55 36.22 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 169.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.554 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 91.3 Cg_exo -50.19 150.5 10.56 Favored 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.264 1.976 . . . . 0.0 114.815 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.7 t -78.4 -178.5 5.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.896 0.855 . . . . 0.0 111.859 -173.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.8 -42.67 89.62 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -85.76 70.21 10.67 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.887 0.851 . . . . 0.0 110.216 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -159.6 141.11 12.94 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.7 -34.62 77.53 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.74 -38.54 89.4 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -67.11 -29.13 68.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.95 -38.77 89.74 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.246 -0.909 . . . . 0.0 111.887 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.77 72.63 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.468 HG11 ' SG ' ' A' ' 6' ' ' CYS . 65.0 t -69.69 -47.08 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.603 -0.686 . . . . 0.0 110.985 175.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.7 t -63.45 -34.07 76.94 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.281 -0.568 . . . . 0.0 112.422 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.92 -36.64 70.43 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.007 -1.058 . . . . 0.0 112.377 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -76.68 -55.42 5.52 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.8 -0.562 . . . . 0.0 111.756 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.2 m -77.82 -52.21 9.27 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -60.41 -26.68 66.88 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -49.0 -29.92 5.43 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -63.88 -60.24 3.52 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.383 -0.823 . . . . 0.0 111.083 173.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.76 92.18 2.23 Favored Glycine 0 N--CA 1.468 0.81 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.996 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -157.41 125.09 5.33 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.423 ' CD1' ' H ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -81.77 166.74 19.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.978 0.894 . . . . 0.0 112.28 -175.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.77 -113.47 4.73 Favored Glycine 0 N--CA 1.466 0.699 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -142.57 47.6 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.71 0.766 . . . . 0.0 110.707 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -93.19 4.7 53.54 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -99.98 -8.44 23.9 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.349 -0.941 . . . . 0.0 113.165 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -35.97 -55.06 0.76 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.73 -38.33 70.48 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -63.61 -38.87 92.76 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.589 -0.694 . . . . 0.0 112.796 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -64.48 -47.42 79.02 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.37 -30.55 66.28 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.44 -62.04 1.7 Allowed 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.468 -0.77 . . . . 0.0 110.344 177.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -85.58 97.27 9.98 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.498 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.2 t . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 169.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.9 tp . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 122.276 1.036 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.598 ' HB3' HD22 ' A' ' 19' ' ' ASN . 76.1 m-85 -105.21 95.09 5.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.257 -174.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -8.71 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -125.59 76.45 1.57 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.861 -172.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.94 -172.99 2.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.774 169.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.92 102.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 122.192 0.996 . . . . 0.0 109.85 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.39 -82.98 0.25 Allowed Glycine 0 N--CA 1.467 0.748 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.45 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.89 145.21 0.07 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -174.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.507 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 74.8 Cg_exo -58.18 162.96 10.7 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 121.927 1.751 . . . . 0.0 114.784 -174.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.5 t -67.02 165.52 15.53 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.636 0.731 . . . . 0.0 111.526 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.08 -54.64 44.7 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.867 -0.52 . . . . 0.0 112.323 -174.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -87.83 79.47 8.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.911 0.862 . . . . 0.0 110.409 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.1 p -153.28 149.88 28.37 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.38 -40.2 89.98 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.48 77.95 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.598 HD22 ' HB3' ' A' ' 5' ' ' TYR . 26.0 t30 -64.28 -33.64 76.29 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.9 -41.72 96.64 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 111.908 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.93 92.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 175.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.439 HG22 ' SG ' ' A' ' 44' ' ' CYS . 67.5 t -66.41 -52.24 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 O-C-N 121.753 -0.592 . . . . 0.0 111.431 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.8 t -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -55.21 -42.12 72.92 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.148 -0.97 . . . . 0.0 112.528 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -76.19 -54.06 7.36 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.807 -0.558 . . . . 0.0 112.137 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.87 -38.42 45.98 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -173.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -67.93 -27.92 67.04 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -86.69 -61.16 1.8 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 118.884 -1.127 . . . . 0.0 111.443 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -92.2 118.79 31.2 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 0.0 109.937 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.14 36.8 5.6 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.359 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -92.91 70.69 4.68 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.757 -0.849 . . . . 0.0 109.311 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.8 mt -138.39 44.7 2.1 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.134 -176.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 80.44 -84.49 1.37 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.146 -1.026 . . . . 0.0 112.838 174.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.65 87.96 7.32 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 122.202 1.001 . . . . 0.0 109.867 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -166.32 -38.09 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.04 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.536 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 97.6 m-85 -72.52 -26.83 61.91 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -65.64 -49.55 68.28 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.167 -0.958 . . . . 0.0 111.356 177.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -68.19 -32.44 72.68 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.7 t -69.45 -47.1 65.1 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.386 -0.821 . . . . 0.0 112.585 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.536 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 5.6 m -71.69 -41.09 69.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.425 -0.797 . . . . 0.0 112.254 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -78.91 -29.5 44.25 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -99.04 -60.49 1.52 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.291 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -69.97 -71.04 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.498 -172.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.507 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 50.3 t . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 -172.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 tt . . . . . 0 N--CA 1.468 0.445 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -135.52 109.09 7.94 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.9 m -13.06 118.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -146.39 83.73 1.62 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 170.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.28 -153.76 0.16 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.519 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.7 mm -71.83 -58.88 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.275 -0.89 . . . . 0.0 110.782 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -76.86 -55.9 4.31 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.836 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.609 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.68 139.28 0.16 Allowed Pre-proline 0 N--CA 1.477 0.881 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -170.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.631 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 39.6 Cg_endo -67.43 176.95 4.31 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 121.738 1.625 . . . . 0.0 113.431 -173.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.3 p -74.12 153.29 39.64 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.656 0.741 . . . . 0.0 111.265 -175.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.498 ' H ' HD12 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -71.14 -3.64 21.06 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.214 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -97.31 -19.08 18.77 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.446 -0.784 . . . . 0.0 112.915 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -75.84 146.69 39.67 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.205 -0.934 . . . . 0.0 110.932 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.02 -41.46 71.38 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -172.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.01 76.91 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -71.25 -35.33 71.37 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.75 -30.44 70.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.246 -0.909 . . . . 0.0 112.893 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.09 33.1 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.26 -0.9 . . . . 0.0 112.051 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.0 p -67.64 -39.67 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.6 p -75.88 -35.55 59.83 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -176.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -66.48 -29.79 69.98 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.81 -52.29 66.08 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.469 -0.769 . . . . 0.0 112.223 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.9 m -76.94 -31.75 56.84 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -66.36 -43.67 85.35 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.994 -1.066 . . . . 0.0 112.257 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -67.62 -43.88 79.36 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.66 -0.65 . . . . 0.0 112.149 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -120.95 100.15 6.91 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -53.97 0.31 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 119.89 -1.148 . . . . 0.0 111.309 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -15.04 100.17 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.6 tp -160.86 -62.27 0.06 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.918 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.37 -68.46 0.29 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.127 -1.189 . . . . 0.0 110.127 -174.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 19.4 m-20 -85.49 85.12 7.45 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.482 ' HD2' ' NE ' ' A' ' 38' ' ' ARG . 38.8 t70 172.86 11.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.2 168.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.481 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 95.9 m-85 -101.3 -29.79 11.86 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.581 -1.324 . . . . 0.0 112.295 169.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -70.23 -50.04 43.93 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.149 -0.969 . . . . 0.0 110.918 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.482 ' NE ' ' HD2' ' A' ' 35' ' ' ASP . 38.3 ptt180 -67.68 -39.65 84.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.4 t -65.46 -43.89 88.91 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.485 -0.76 . . . . 0.0 113.051 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.481 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 73.5 m -63.69 -62.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.853 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -42.33 -62.65 0.91 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -174.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -36.95 -62.15 0.51 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -173.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -91.74 -12.15 34.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.631 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.9 t . . . . . 0 N--CA 1.468 0.448 0 O-C-N 121.136 -0.977 . . . . 0.0 110.522 -174.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.8 tp . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -94.37 161.43 14.24 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.858 0.837 . . . . 0.0 110.215 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 t -82.5 85.29 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -124.8 77.26 1.59 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.014 -0.675 . . . . 0.0 110.199 -171.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.08 -106.16 0.11 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.629 -0.829 . . . . 0.0 109.451 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.5 mm -90.41 -69.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -171.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.78 -50.98 4.2 Favored Glycine 0 N--CA 1.47 0.923 0 C-N-CA 120.126 -1.035 . . . . 0.0 113.71 -172.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t -20.85 133.87 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -170.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.721 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 71.2 Cg_exo -54.43 170.98 0.46 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.329 2.019 . . . . 0.0 114.941 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -61.68 164.81 5.67 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 122.123 0.963 . . . . 0.0 112.698 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -171.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -99.61 52.05 0.93 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.781 -174.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.2 p -108.21 166.36 10.8 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.778 0.799 . . . . 0.0 110.178 176.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.32 -44.62 78.71 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.423 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.17 81.18 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -65.46 -29.8 70.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.7 -41.46 90.8 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.407 -0.808 . . . . 0.0 113.124 -178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.03 69.74 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.562 -0.711 . . . . 0.0 112.817 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.01 -39.79 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.5 p -66.36 -21.95 66.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -82.48 -23.34 34.76 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 171.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -85.64 -49.73 7.77 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.47 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.94 -28.34 64.41 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -67.44 -26.05 66.21 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.954 -1.091 . . . . 0.0 113.279 171.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -84.08 -44.22 14.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 118.852 -1.139 . . . . 0.0 111.117 168.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -85.21 71.76 10.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.222 -0.924 . . . . 0.0 109.189 171.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -132.64 125.1 4.04 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -83.98 -101.48 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.022 -0.671 . . . . 0.0 109.432 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.7 mt -140.4 76.19 1.54 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.77 -44.73 3.39 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 119.923 -1.132 . . . . 0.0 113.843 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.455 ' CG ' ' H ' ' A' ' 35' ' ' ASP . 10.5 p-10 -68.18 -69.03 0.35 Allowed 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.985 -0.715 . . . . 0.0 111.914 -174.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.455 ' H ' ' CG ' ' A' ' 34' ' ' ASP . 13.3 t70 -19.47 -67.1 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 -173.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -35.32 -47.37 0.41 Allowed 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -174.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -35.39 -53.65 0.65 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -175.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -66.4 -61.21 2.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.444 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.8 t -37.07 -49.13 0.84 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.1 m -72.49 -35.63 68.21 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -175.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -72.35 -48.55 41.03 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.294 -0.879 . . . . 0.0 111.323 175.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -81.44 -96.27 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -34.14 -53.2 0.48 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -173.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.721 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 43.5 t . . . . . 0 N--CA 1.468 0.454 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.5 tp . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 117.734 2.494 . . . . 0.0 117.734 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -99.36 139.24 35.31 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.962 175.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.8 t -83.92 93.72 8.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.712 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -97.76 78.51 2.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.833 0.825 . . . . 0.0 109.234 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 155.54 32.28 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.636 0.732 . . . . 0.0 110.762 177.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.59 110.63 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 121.871 0.843 . . . . 0.0 109.9 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.3 -42.39 1.82 Allowed Glycine 0 CA--C 1.53 1.013 0 C-N-CA 120.237 -0.982 . . . . 0.0 112.001 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.2 m -80.74 169.47 19.39 Favored Pre-proline 0 CA--C 1.542 0.645 0 O-C-N 122.096 -0.649 . . . . 0.0 110.71 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -58.63 152.84 53.03 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 121.877 1.718 . . . . 0.0 115.44 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -76.68 164.43 25.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.556 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.1 tp -50.29 -50.4 50.56 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -173.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -90.84 36.75 0.91 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.737 -0.785 . . . . 0.0 112.834 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.6 p -109.98 151.25 27.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.954 0.883 . . . . 0.0 110.451 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.33 -33.54 75.74 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.64 -55.68 24.75 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.718 -0.613 . . . . 0.0 111.215 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -37.92 -40.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -177.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.9 mp -54.13 -38.41 65.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.46 -43.42 66.68 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p -65.23 -22.75 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -82.42 -55.19 4.65 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 118.224 -1.39 . . . . 0.0 109.493 167.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -36.14 -54.98 0.79 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -175.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.93 -46.42 24.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -177.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.4 m -63.07 -50.24 71.37 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.548 -0.72 . . . . 0.0 112.385 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -55.85 -32.68 63.84 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.8 -29.31 68.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 175.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -76.04 95.33 3.59 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.67 0.748 . . . . 0.0 110.043 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.41 -130.61 9.95 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.468 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -163.76 -56.19 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.331 -0.548 . . . . 0.0 109.964 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.2 tp -145.38 111.75 5.74 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.75 -167.08 37.23 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.719 -1.229 . . . . 0.0 111.846 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -89.49 15.37 9.43 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.15 -27.93 57.18 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.232 -0.918 . . . . 0.0 112.614 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.451 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 22.6 m-85 -71.6 -24.74 61.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -172.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.34 -49.3 77.51 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.416 -0.803 . . . . 0.0 112.072 -177.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -63.45 -39.2 93.85 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.675 -0.641 . . . . 0.0 112.455 176.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.0 t -61.47 -44.95 96.18 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 4.4 m -73.69 -29.21 62.15 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.95 -26.85 66.32 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 172.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -92.39 -98.91 0.13 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 167.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -36.57 112.85 0.2 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 52.7 t . . . . . 0 N--CA 1.47 0.567 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.268 -169.681 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 44.2 tp . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -84.18 85.86 7.3 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.809 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -26.14 121.18 0.07 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.578 2.066 . . . . 0.0 116.578 -175.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -89.36 78.97 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.749 0.785 . . . . 0.0 109.852 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.83 154.51 35.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.69 0.757 . . . . 0.0 110.144 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.4 mm -81.03 99.86 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-O 121.667 0.746 . . . . 0.0 109.937 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.81 -82.65 0.15 Allowed Glycine 0 N--CA 1.467 0.726 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.634 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.8 t -35.19 150.75 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -171.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.634 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 87.9 Cg_exo -55.87 -173.29 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.4 2.067 . . . . 0.0 116.541 -174.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.7 m -50.91 146.33 6.17 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.436 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.6 tp -55.8 -51.91 65.83 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -100.08 81.9 2.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.694 0.759 . . . . 0.0 109.282 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -143.67 171.27 14.42 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.842 0.829 . . . . 0.0 110.341 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -67.58 -43.0 81.65 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.761 -0.587 . . . . 0.0 112.36 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.57 -45.21 80.05 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.733 -0.604 . . . . 0.0 112.462 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.7 -31.53 72.59 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.3 tp -64.32 -41.7 96.68 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.297 -0.877 . . . . 0.0 112.297 175.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.23 76.46 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.636 -0.665 . . . . 0.0 112.785 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.577 HG13 ' SG ' ' A' ' 11' ' ' CYS . 14.6 p -62.72 -41.43 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.691 -0.631 . . . . 0.0 112.396 178.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.9 p -66.43 -29.93 70.18 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -67.06 -28.61 68.34 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -86.71 -63.21 1.35 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 118.293 -1.363 . . . . 0.0 109.76 167.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.44 ' SG ' HG23 ' A' ' 22' ' ' VAL . 73.1 m -37.25 -47.84 0.83 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.378 1.992 . . . . 0.0 116.378 -174.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -51.76 -29.16 17.64 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -57.31 -29.31 63.82 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -71.34 176.19 4.8 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.96 0.886 . . . . 0.0 110.662 175.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.4 120.02 17.78 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 120.392 -0.909 . . . . 0.0 113.298 -174.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 ttmt -84.52 95.69 8.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.698 0.761 . . . . 0.0 110.084 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -113.1 -45.27 3.18 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.95 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.36 -89.12 0.08 OUTLIER Glycine 0 CA--C 1.523 0.575 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -101.21 44.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.676 0.751 . . . . 0.0 110.376 172.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -96.39 3.63 52.75 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.606 -0.684 . . . . 0.0 112.54 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -99.68 -1.65 37.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.695 169.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -34.05 -54.3 0.48 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -68.29 -57.46 5.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.02 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 23.0 t -40.02 -38.46 0.72 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 117.571 2.434 . . . . 0.0 117.571 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.3 m -90.18 -24.63 20.97 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 172.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -86.22 -25.71 25.46 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -96.58 -46.89 6.15 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.149 -0.969 . . . . 0.0 112.139 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -99.18 71.03 1.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 118.993 -1.083 . . . . 0.0 110.719 170.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.588 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.7 t . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 166.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 121.584 0.707 . . . . 0.0 109.276 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.15 147.87 26.4 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.3 t -85.22 107.56 17.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.058 -173.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -99.92 80.65 2.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.696 0.76 . . . . 0.0 109.447 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.59 -149.28 0.25 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.603 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.51 111.6 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 169.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.84 38.0 6.65 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.414 -0.898 . . . . 0.0 113.337 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.654 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.6 t -117.93 153.22 50.96 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.654 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -56.49 175.75 0.25 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.093 1.862 . . . . 0.0 114.852 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 75.3 p -59.93 149.21 32.43 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.592 0.71 . . . . 0.0 111.461 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.84 -47.03 77.98 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -171.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.16 0.1 46.82 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -177.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -73.12 161.12 30.99 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.902 -1.124 . . . . 0.0 111.626 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -67.63 -33.16 74.42 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.08 -43.57 86.96 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.591 -0.693 . . . . 0.0 112.53 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -66.96 -36.55 82.45 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.644 -0.66 . . . . 0.0 112.313 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.72 -42.63 99.75 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.67 -0.644 . . . . 0.0 111.701 175.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.32 -43.18 99.41 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.79 -37.49 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.55 -0.719 . . . . 0.0 112.469 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -64.01 -35.11 79.65 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.531 -0.731 . . . . 0.0 112.096 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -57.36 -40.56 78.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -68.39 -63.95 0.96 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.528 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.0 m -41.97 -43.48 3.15 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.1 -28.77 69.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -178.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -57.97 -26.24 62.06 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.56 -49.75 76.54 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.72 -0.613 . . . . 0.0 112.054 176.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 133.96 83.79 0.21 Allowed Glycine 0 N--CA 1.468 0.82 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 178.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -14.2 100.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -168.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -89.56 -53.6 4.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.628 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.71 -73.76 0.41 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 -171.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -86.64 73.41 10.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.42 1.105 . . . . 0.0 109.895 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -157.52 -41.59 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.168 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -65.81 -31.75 72.88 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.76 -52.43 56.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.564 -0.71 . . . . 0.0 111.48 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -68.55 -38.36 80.72 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.699 -0.626 . . . . 0.0 112.606 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -55.79 -52.98 62.09 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.8 m -77.86 -33.62 52.08 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -62.06 -28.58 69.71 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -95.87 -35.34 11.51 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 119.102 -1.039 . . . . 0.0 112.538 171.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.9 -78.6 0.1 Allowed 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.205 -0.935 . . . . 0.0 110.126 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.561 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 33.9 t . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 117.338 2.347 . . . . 0.0 117.338 -173.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -97.0 131.4 43.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.825 0.822 . . . . 0.0 110.065 -170.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 23' ' ' SER . 28.8 p -85.82 100.17 11.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.843 -172.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -98.63 85.78 3.42 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 172.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.96 -148.21 0.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.81 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.8 mt -116.67 100.96 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 169.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 140.99 -54.13 0.64 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.217 -0.992 . . . . 0.0 110.686 -173.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.603 ' SG ' HG23 ' A' ' 22' ' ' VAL . 5.0 t -77.76 161.52 71.28 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.297 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.589 ' CD ' ' SG ' ' A' ' 11' ' ' CYS . 52.1 Cg_exo -71.16 -174.67 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 CA-C-N 120.816 1.327 . . . . 0.0 114.352 -169.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -73.44 146.77 44.76 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.512 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -18.97 64.59 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -175.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -72.61 -31.17 64.97 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.47 -0.769 . . . . 0.0 112.357 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.0 p -73.75 149.28 41.88 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.739 0.781 . . . . 0.0 111.29 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -67.52 -24.26 65.54 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.28 -43.72 98.18 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.55 -0.718 . . . . 0.0 112.717 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -73.79 -29.4 62.15 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.944 -0.702 . . . . 0.0 112.301 177.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.8 -43.47 98.73 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.353 -0.842 . . . . 0.0 112.591 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.42 -42.68 82.82 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.603 HG23 ' SG ' ' A' ' 11' ' ' CYS . 30.1 m -68.76 -25.3 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.519 ' HB2' ' SG ' ' A' ' 6' ' ' CYS . 10.4 t -85.59 -26.91 25.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 118.848 -1.141 . . . . 0.0 113.19 168.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -50.42 -44.07 55.13 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.393 0.997 . . . . 0.0 113.257 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.02 -62.0 1.74 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.752 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.4 m -44.43 -34.39 2.02 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -85.35 -39.43 17.65 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 172.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -66.15 -57.97 6.46 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.997 -1.065 . . . . 0.0 110.761 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -108.6 88.44 2.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.04 -60.19 0.28 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 119.24 -1.457 . . . . 0.0 112.764 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -15.26 111.15 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -168.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -154.33 -51.89 0.09 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.146 -0.621 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.26 -72.21 0.25 Allowed Glycine 0 N--CA 1.466 0.683 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -174.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -67.74 -50.14 58.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.781 173.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -18.91 -57.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -53.03 -54.41 35.71 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -172.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -38.89 -61.49 0.73 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -72.89 -36.96 67.44 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -54.1 -51.43 64.22 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.0 m -77.19 -52.59 8.98 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.409 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -54.7 -37.26 65.62 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -69.54 -56.73 6.53 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.526 -0.734 . . . . 0.0 110.982 175.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.57 56.22 3.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.761 -0.587 . . . . 0.0 111.649 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.406 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.4 t . . . . . 0 N--CA 1.472 0.653 0 O-C-N 121.49 -0.756 . . . . 0.0 109.761 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -94.29 142.13 27.76 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.861 0.838 . . . . 0.0 109.01 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.48 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 11.9 t -76.63 135.1 39.15 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.934 -171.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -89.36 83.28 6.41 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.22 143.26 33.19 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.697 0.761 . . . . 0.0 110.013 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.5 pt -73.85 -24.73 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.49 60.49 0.54 Allowed Glycine 0 N--CA 1.469 0.86 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.926 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.708 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 15.1 t -116.93 156.0 48.63 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 169.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.708 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 85.0 Cg_exo -59.9 -179.71 0.23 Allowed 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.801 1.667 . . . . 0.0 115.535 -174.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -62.58 163.78 8.5 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.79 0.805 . . . . 0.0 112.612 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.5 tp -57.68 -50.72 72.25 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -171.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -94.35 50.29 1.36 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.999 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.9 p -112.85 169.53 8.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.833 0.825 . . . . 0.0 110.296 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.03 -40.97 78.29 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.135 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.5 -44.05 75.56 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -64.52 -33.08 75.06 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.52 -41.21 89.17 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.507 -0.745 . . . . 0.0 112.159 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.26 -62.21 1.5 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.58 -0.7 . . . . 0.0 111.317 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.411 HG13 ' SG ' ' A' ' 11' ' ' CYS . 12.1 p -42.19 -46.21 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -174.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -71.25 -40.4 71.02 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -63.25 -38.04 89.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.79 -63.92 0.96 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.421 -0.799 . . . . 0.0 109.769 176.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -44.3 -40.07 4.99 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -56.89 -46.72 81.71 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -67.57 -57.92 5.61 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.772 -0.58 . . . . 0.0 111.143 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -96.5 82.27 3.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 141.55 40.23 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 120.22 -0.991 . . . . 0.0 112.934 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -87.45 81.79 7.71 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.998 -0.707 . . . . 0.0 109.163 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -138.24 -58.62 0.64 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.722 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.04 -68.86 0.5 Allowed Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -172.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -89.8 78.6 6.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 122.455 1.121 . . . . 0.0 108.867 175.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -161.14 -56.98 0.05 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.48 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 90.8 m-85 -38.78 -40.43 0.62 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -174.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -57.96 -47.56 82.57 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -67.78 -41.32 83.44 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.65 -0.656 . . . . 0.0 112.116 176.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -59.39 -45.64 90.9 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 22.6 m -77.22 -40.72 44.02 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -175.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -68.2 -29.82 68.77 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -68.97 -48.7 62.52 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.392 -0.817 . . . . 0.0 111.84 178.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.62 -57.16 3.45 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.805 -0.559 . . . . 0.0 110.967 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 42.6 t . . . . . 0 N--CA 1.468 0.437 0 CA-C-O 122.016 0.912 . . . . 0.0 111.34 -176.878 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -131.19 165.4 23.42 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.39 137.47 56.9 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.32 -0.862 . . . . 0.0 111.665 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -131.71 76.92 1.74 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 171.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -94.64 -176.49 3.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.922 0.868 . . . . 0.0 111.048 -176.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.9 mm -71.39 -56.68 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.765 -0.585 . . . . 0.0 111.113 -175.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.59 33.94 5.83 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 120.021 -1.085 . . . . 0.0 113.997 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.599 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.9 t -116.87 160.4 36.95 Favored Pre-proline 0 CA--C 1.543 0.682 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.599 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.1 Cg_exo -67.61 -178.32 1.51 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 CA-C-N 121.082 1.422 . . . . 0.0 114.099 -171.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.3 t -66.23 158.39 29.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.725 0.774 . . . . 0.0 111.594 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.57 -55.23 37.51 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.346 -173.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.41 80.44 8.13 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.927 0.87 . . . . 0.0 110.24 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.9 p -153.81 153.85 32.89 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.549 0.69 . . . . 0.0 109.396 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.42 -36.47 84.27 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -48.5 73.26 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.667 -0.645 . . . . 0.0 112.256 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -63.17 -37.23 86.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.721 -0.612 . . . . 0.0 112.605 175.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.17 -44.17 95.25 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.895 -0.503 . . . . 0.0 111.727 178.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.96 -39.15 93.82 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.653 0.982 . . . . 0.0 113.653 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.0 t -59.6 -49.56 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 O-C-N 121.64 -0.662 . . . . 0.0 111.196 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 95.0 p -66.0 -30.4 70.94 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -61.85 -28.41 69.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -88.25 -55.35 3.78 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 118.769 -1.172 . . . . 0.0 112.896 169.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.7 m -77.99 -47.07 19.36 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -171.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -57.71 -29.37 64.65 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.59 -28.01 65.18 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -77.55 93.27 4.15 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.488 -0.757 . . . . 0.0 110.05 177.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.59 -133.37 11.63 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 119.959 -1.115 . . . . 0.0 111.065 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -164.75 -56.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.094 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -78.28 152.72 32.34 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 122.013 0.911 . . . . 0.0 111.523 -171.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.1 71.9 2.31 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.188 -1.006 . . . . 0.0 113.063 -175.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -141.43 55.86 1.52 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 122.256 1.027 . . . . 0.0 108.424 170.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -174.16 -41.77 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.333 -174.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -68.35 -22.56 64.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -31.31 -51.25 0.18 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -173.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -61.49 -63.53 1.24 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.582 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 14.5 t -38.73 -49.9 1.62 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 17.0 t -68.81 -27.46 65.88 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -87.13 -61.66 1.67 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.019 166.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -28.52 -63.73 0.1 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -88.0 -50.94 6.09 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.465 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.517 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 51.4 t . . . . . 0 N--CA 1.467 0.389 0 CA-C-O 122.146 0.974 . . . . 0.0 110.841 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -127.92 102.17 22.33 Favored Pre-proline 0 N--CA 1.47 0.555 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -60.32 127.4 22.85 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 121.944 1.763 . . . . 0.0 113.2 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.3 tp -93.83 103.35 15.48 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.643 0.735 . . . . 0.0 109.791 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -126.47 165.7 18.62 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 122.211 1.005 . . . . 0.0 109.736 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.4 t -78.89 145.73 33.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.139 0.971 . . . . 0.0 112.891 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -141.01 75.87 1.52 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 169.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.42 -171.82 2.75 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.567 0.699 . . . . 0.0 110.879 -175.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.8 mm -73.32 -64.25 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.586 -0.696 . . . . 0.0 111.01 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.54 -58.91 3.7 Favored Glycine 0 N--CA 1.469 0.869 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.471 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -39.44 155.61 0.15 Allowed Pre-proline 0 N--CA 1.476 0.859 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.35 147.15 12.52 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.274 1.982 . . . . 0.0 114.928 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -67.19 162.36 22.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.683 0.754 . . . . 0.0 111.476 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.9 tp -55.24 -46.48 76.01 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -169.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -102.02 42.38 1.14 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.534 -175.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.7 p -106.8 158.56 16.9 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.386 -0.821 . . . . 0.0 110.124 175.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -63.64 -39.91 95.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.435 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.47 69.95 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.0 -39.57 94.41 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.2 -39.2 74.91 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.505 -0.747 . . . . 0.0 112.544 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.26 -50.53 60.12 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.58 -0.7 . . . . 0.0 112.633 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -73.18 -39.24 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.6 p -71.42 -31.86 67.72 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -66.12 -32.43 73.88 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.538 -0.726 . . . . 0.0 112.574 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -63.08 -45.73 90.72 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.596 -0.69 . . . . 0.0 111.776 174.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.9 m -69.93 -35.53 74.6 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.75 -40.43 97.24 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.578 -0.701 . . . . 0.0 112.261 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.36 -37.99 89.46 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -76.13 126.31 30.76 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.958 0.885 . . . . 0.0 110.521 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.24 -134.93 17.7 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.738 179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -165.49 -67.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -154.27 105.42 2.69 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.99 -114.51 0.45 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.146 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.4 -55.01 4.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.757 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -18.67 -67.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -38.69 -40.67 0.63 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 -170.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -72.56 -51.27 20.56 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.236 -0.915 . . . . 0.0 111.951 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -72.03 -25.6 61.87 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.5 t -84.75 -24.16 28.93 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 171.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.6 t -85.92 -23.74 26.86 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 170.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -84.93 -33.62 22.66 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 118.726 -1.19 . . . . 0.0 112.384 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.45 -50.88 19.38 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.967 -1.083 . . . . 0.0 111.143 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -98.7 92.41 5.57 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 167.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t -102.12 -64.27 1.08 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.926 -173.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.3 -89.65 0.08 OUTLIER Glycine 0 CA--C 1.524 0.642 0 C-N-CA 119.838 -1.172 . . . . 0.0 110.434 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.0 t -88.91 105.5 17.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 109.699 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.4 t -88.1 140.88 29.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.741 0.781 . . . . 0.0 110.437 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.5 t -86.01 137.72 35.25 Favored Pre-proline 0 N--CA 1.47 0.542 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.084 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.57 112.72 3.21 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.718 1.612 . . . . 0.0 110.906 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.41 121.16 4.16 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 70.0 m -90.46 109.78 20.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.426 0.631 . . . . 0.0 109.721 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.176 -179.88 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -132.09 93.6 26.17 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -177.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.412 ' O ' ' C ' ' A' ' 4' ' ' LEU . 93.5 Cg_endo -79.78 -105.18 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 121.602 1.535 . . . . 0.0 109.943 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.412 ' C ' ' O ' ' A' ' 3' ' ' PRO . 6.4 tt -16.63 106.46 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -169.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -90.13 142.39 27.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.106 0.955 . . . . 0.0 111.148 -170.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.523 ' H ' ' HB3' ' A' ' 23' ' ' SER . 4.3 t -67.45 109.08 3.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.414 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -134.39 78.52 1.76 Allowed 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 175.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.465 ' HB1' ' SG ' ' A' ' 40' ' ' CYS . . . -81.49 -102.54 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.894 -176.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.61 107.8 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 119.673 -0.811 . . . . 0.0 108.83 169.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.04 -49.61 1.14 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 120.124 -1.036 . . . . 0.0 113.122 176.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 m -27.37 145.28 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 116.893 2.182 . . . . 0.0 116.893 -169.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -48.63 163.99 0.24 Allowed 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.667 2.245 . . . . 0.0 116.887 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.6 m -57.08 145.49 30.68 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.862 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 mp -53.02 -51.46 61.62 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -175.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -98.04 75.12 2.32 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.845 0.831 . . . . 0.0 110.192 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.7 p -148.27 165.98 29.36 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.583 0.706 . . . . 0.0 109.615 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -65.16 -35.31 80.71 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -46.13 67.43 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.406 -0.809 . . . . 0.0 111.971 177.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.13 -29.72 70.59 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -57.63 -47.51 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.686 -0.634 . . . . 0.0 112.286 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.55 -62.57 1.39 Allowed 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.445 -0.785 . . . . 0.0 111.083 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -53.37 -28.8 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -174.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.523 ' HB3' ' H ' ' A' ' 6' ' ' CYS . 89.6 p -86.51 -29.84 22.42 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -62.68 -25.99 68.43 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.953 -1.092 . . . . 0.0 113.15 171.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -85.86 -43.82 12.95 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.926 168.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.66 -41.77 95.86 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.974 1.261 . . . . 0.0 112.645 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 tpt180 -64.73 -26.5 68.39 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -84.42 -31.48 24.62 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.609 168.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -78.93 -166.05 0.84 Allowed 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.348 -0.845 . . . . 0.0 109.09 169.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.98 -126.42 13.66 Favored Glycine 0 N--CA 1.469 0.868 0 C-N-CA 119.877 -1.154 . . . . 0.0 112.371 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -157.92 -81.66 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.942 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -157.79 -53.89 0.07 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.37 -173.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.78 -109.29 3.03 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 120.203 -0.999 . . . . 0.0 111.651 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -93.18 30.88 1.55 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -86.72 -16.11 37.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.338 -0.852 . . . . 0.0 112.367 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -69.85 -15.03 63.03 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -33.01 -52.78 0.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -172.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 48.3 mtm105 -64.18 -61.78 2.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.678 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 21.0 t -40.97 -47.77 3.07 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.465 ' SG ' ' HB1' ' A' ' 8' ' ' ALA . 46.6 t -76.26 -36.81 58.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -71.53 -47.39 55.52 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.598 -0.689 . . . . 0.0 111.406 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -71.16 -43.96 66.48 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.794 -0.566 . . . . 0.0 111.977 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -98.72 86.13 3.47 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 53.9 t -102.5 -57.18 2.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.76 -177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.01 -55.6 0.53 Allowed Glycine 0 N--CA 1.469 0.833 0 C-N-CA 120.418 -0.896 . . . . 0.0 111.225 -176.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.0 m -137.34 140.27 41.37 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 176.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 69.2 p -135.46 -50.26 0.73 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.614 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.2 m -15.1 101.29 0.05 OUTLIER Pre-proline 0 N--CA 1.481 1.079 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -169.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -62.24 126.08 17.79 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 121.839 1.693 . . . . 0.0 113.276 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.0 121.37 4.38 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.8 t -86.63 -60.78 1.9 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.133 -0.627 . . . . 0.0 111.053 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.373 -0.822 . . . . 0.0 111.269 -177.841 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.23 144.22 33.89 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.937 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.74 121.5 5.95 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.874 1.716 . . . . 0.0 111.258 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.0 tp -89.9 113.52 25.15 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -90.64 77.58 6.35 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.392 0.615 . . . . 0.0 109.574 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -28.82 112.73 0.07 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 -171.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -117.99 83.73 2.05 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.893 0.854 . . . . 0.0 109.504 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.87 169.2 18.4 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.746 0.784 . . . . 0.0 111.13 175.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -71.86 105.82 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 122.11 0.957 . . . . 0.0 110.302 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.87 -80.39 0.29 Allowed Glycine 0 N--CA 1.468 0.798 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -173.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -33.41 153.66 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.868 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 -175.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -44.21 141.38 4.88 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.812 2.341 . . . . 0.0 116.592 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.6 t -86.97 177.8 7.13 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.256 -176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.0 tp -54.49 -40.37 68.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -82.06 81.65 7.93 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.463 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.5 p 168.38 138.96 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 166.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -65.33 -20.74 66.53 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.3 -33.57 73.79 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.326 -0.859 . . . . 0.0 113.039 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -70.96 -40.04 72.2 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.725 173.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.09 -35.87 74.15 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 177.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.72 66.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.624 -0.672 . . . . 0.0 112.684 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.2 p -70.91 -36.59 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 O-C-N 121.671 -0.643 . . . . 0.0 112.715 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.0 p -67.93 -37.99 82.33 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.608 -0.683 . . . . 0.0 112.618 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -59.77 -35.97 75.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -65.45 -45.59 83.18 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.705 -0.622 . . . . 0.0 112.148 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.1 m -72.47 -38.13 68.3 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.659 -0.651 . . . . 0.0 112.582 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -65.91 -26.86 67.8 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.63 -39.03 49.33 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -71.91 -57.66 4.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.743 170.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.3 74.87 1.25 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 120.171 -1.014 . . . . 0.0 112.079 173.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -102.56 148.14 25.92 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.631 0.729 . . . . 0.0 110.046 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.8 mt -126.75 86.1 2.47 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 174.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 157.78 -83.42 0.14 Allowed Glycine 0 CA--C 1.526 0.763 0 C-N-CA 119.759 -1.21 . . . . 0.0 111.621 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 28.2 t70 -142.92 129.73 20.46 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 32.7 t70 172.87 -56.89 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 169.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -32.93 -49.53 0.24 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -33.86 -58.05 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -66.52 -60.2 2.95 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.52 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -36.72 -46.31 0.59 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 m -73.54 -45.71 51.98 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -67.25 -29.9 69.65 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.09 -50.24 62.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.43 -0.794 . . . . 0.0 111.646 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -87.46 72.64 9.67 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.009 0.909 . . . . 0.0 109.028 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.1 t -166.64 -66.27 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.26 -108.5 0.36 Allowed Glycine 0 N--CA 1.466 0.662 0 C-N-CA 119.823 -1.18 . . . . 0.0 110.728 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.6 m -142.07 107.29 4.98 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.3 p -86.92 132.34 33.84 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.014 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.8 t -14.91 102.34 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.032 0 N-CA-C 117.166 2.284 . . . . 0.0 117.166 -169.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -84.8 97.02 0.67 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 121.405 1.403 . . . . 0.0 110.755 -174.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -24.11 -66.42 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 -172.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -16.43 -73.06 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 117.842 2.534 . . . . 0.0 117.842 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.148 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.461 -177.644 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -114.41 104.8 54.41 Favored Pre-proline 0 CA--C 1.538 0.481 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.9 77.44 2.97 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 121.534 1.489 . . . . 0.0 111.452 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.8 tt -97.14 109.07 21.9 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -115.05 77.15 1.04 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.126 -174.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -26.37 120.79 0.08 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.882 2.179 . . . . 0.0 116.882 -172.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -94.13 79.67 4.04 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.862 0.839 . . . . 0.0 109.494 178.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -87.44 151.44 23.05 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.651 0.739 . . . . 0.0 110.826 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.72 110.32 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.884 0.85 . . . . 0.0 109.063 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.94 -48.36 0.95 Allowed Glycine 0 CA--C 1.528 0.863 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.169 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.616 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 16.2 t -64.87 150.13 95.31 Favored Pre-proline 0 CA--C 1.542 0.641 0 O-C-N 122.213 -0.581 . . . . 0.0 111.65 -175.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.616 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 92.5 Cg_exo -57.99 174.43 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 121.926 1.751 . . . . 0.0 115.696 -174.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -63.12 167.26 5.12 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.986 0.898 . . . . 0.0 112.849 -174.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 74.6 mt -52.96 -53.65 46.56 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -173.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -97.61 90.49 5.03 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.847 0.832 . . . . 0.0 109.063 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -148.38 176.49 10.23 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.942 0.877 . . . . 0.0 109.956 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -68.15 -45.34 73.81 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.465 -0.772 . . . . 0.0 112.413 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.61 -62.12 1.51 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.927 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -40.57 -48.72 2.9 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.581 1.696 . . . . 0.0 115.581 -172.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.71 -45.71 77.82 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.48 71.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.707 -0.62 . . . . 0.0 112.649 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.1 m -68.5 -35.47 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -70.04 -33.54 72.1 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.735 -0.603 . . . . 0.0 112.578 176.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -65.13 -38.61 91.2 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.635 -0.666 . . . . 0.0 112.241 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.99 -44.69 97.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.921 -0.487 . . . . 0.0 112.161 174.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.0 m -72.67 -32.9 66.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.2 tpt85 -69.51 -37.54 77.21 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.68 -32.83 74.44 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -142.87 81.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.93 0.871 . . . . 0.0 109.028 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.28 36.16 0.02 OUTLIER Glycine 0 CA--C 1.529 0.96 0 C-N-CA 119.854 -1.165 . . . . 0.0 113.138 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -83.55 94.52 8.08 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.83 0.824 . . . . 0.0 109.906 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.09 -44.28 0.57 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.866 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.6 44.92 1.48 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.45 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -170.74 -46.59 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -29.81 70.85 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -59.63 -33.34 71.38 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -65.44 -54.77 23.66 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.593 -0.692 . . . . 0.0 111.419 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -71.12 -32.73 69.37 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.5 t -67.05 -44.73 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -176.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 m -66.18 -37.57 85.93 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -53.32 -52.38 59.34 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.843 0.747 . . . . 0.0 112.263 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -29.69 -54.7 0.16 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -99.51 -34.87 10.08 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.446 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.9 t -62.21 -51.12 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.354 -0.841 . . . . 0.0 113.227 -175.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.12 -105.42 2.57 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.994 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 t -151.19 -73.98 0.15 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.552 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.4 p -140.37 132.72 28.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.7 t -143.81 138.9 15.58 Favored Pre-proline 0 N--CA 1.471 0.58 0 C-N-CA 120.179 -0.609 . . . . 0.0 109.366 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.39 134.22 12.45 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 121.726 1.617 . . . . 0.0 111.278 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.9 111.75 19.07 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 120.092 -0.643 . . . . 0.0 110.327 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.8 p -88.39 -60.21 2.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.149 -0.62 . . . . 0.0 111.057 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.605 -0.712 . . . . 0.0 110.199 179.084 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -124.32 96.69 41.26 Favored Pre-proline 0 N--CA 1.47 0.568 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.4 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 97.7 Cg_endo -84.0 168.2 12.25 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.557 1.505 . . . . 0.0 112.032 -175.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 3' ' ' PRO . 60.5 tp 170.14 97.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 167.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -104.81 156.4 18.04 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.93 0.871 . . . . 0.0 110.355 -174.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.406 ' H ' ' HB2' ' A' ' 23' ' ' SER . 9.3 t -85.46 131.82 34.32 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.38 0.609 . . . . 0.0 111.145 -176.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -133.8 78.01 1.74 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.12 -160.12 0.64 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.435 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.27 100.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 169.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.08 -53.98 0.5 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.796 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.655 ' SG ' ' CD ' ' A' ' 12' ' ' PRO . 4.0 t -74.07 167.19 37.9 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 122.456 -0.437 . . . . 0.0 109.988 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.655 ' CD ' ' SG ' ' A' ' 11' ' ' CYS . 71.5 Cg_exo -66.12 175.23 4.98 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.402 1.401 . . . . 0.0 114.739 -169.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.0 m -67.98 142.78 55.86 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.46 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.71 -40.4 72.37 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.8 60.28 5.83 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.762 0.792 . . . . 0.0 110.728 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.9 p -156.53 143.62 18.86 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.08 -23.99 66.84 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -38.31 90.62 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 112.487 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -67.35 -39.94 85.8 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.747 -0.596 . . . . 0.0 112.025 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.81 -37.74 69.04 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.73 -43.98 87.37 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.472 -0.768 . . . . 0.0 112.693 176.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.578 HG12 ' SG ' ' A' ' 11' ' ' CYS . 97.4 t -72.89 -47.1 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.756 -0.59 . . . . 0.0 111.629 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.406 ' HB2' ' H ' ' A' ' 6' ' ' CYS . 90.9 p -67.85 -24.66 65.29 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -83.93 -22.98 31.34 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 171.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -83.44 -32.11 26.24 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 118.335 -1.346 . . . . 0.0 112.117 168.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -66.34 -41.39 89.65 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 120.968 -1.083 . . . . 0.0 111.789 170.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.8 tpt85 -35.02 -52.53 0.56 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -35.12 -57.87 0.56 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -171.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -90.24 106.11 18.27 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -175.74 92.16 0.09 OUTLIER Glycine 0 N--CA 1.465 0.608 0 C-N-CA 119.181 -1.485 . . . . 0.0 111.57 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -86.28 -61.6 1.71 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.97 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.5 mt -125.02 -62.54 1.22 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.85 80.48 0.08 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -135.99 -53.58 0.75 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.526 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.15 -56.46 6.8 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 120.326 -0.549 . . . . 0.0 111.399 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -29.54 -53.97 0.14 Allowed 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -172.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -39.55 -55.88 1.75 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -172.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.466 ' HG3' ' H ' ' A' ' 39' ' ' CYS . 40.2 ptt180 -65.9 -56.77 10.07 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.189 -0.605 . . . . 0.0 111.057 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.466 ' H ' ' HG3' ' A' ' 38' ' ' ARG . 42.7 t -38.23 -51.62 1.47 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.72 -34.87 52.53 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -77.57 -28.5 51.77 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -178.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -96.81 -94.36 0.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 119.351 -0.94 . . . . 0.0 108.809 170.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -28.78 -64.21 0.1 Allowed 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.589 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 42.6 t -17.75 -69.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.12 142.26 3.4 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.7 m -83.11 98.24 9.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.011 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 55.4 p -14.28 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 -169.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.8 m 168.46 94.25 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.917 0 N-CA-C 103.854 -2.647 . . . . 0.0 103.854 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -84.6 99.44 0.74 Allowed 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.344 1.363 . . . . 0.0 110.848 -174.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.13 111.21 19.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.487 0.66 . . . . 0.0 110.285 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.5 p -90.61 129.1 36.77 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.584 0.707 . . . . 0.0 110.251 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.635 -0.697 . . . . 0.0 109.345 179.57 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 121.38 0.609 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -88.41 137.16 30.82 Favored Pre-proline 0 N--CA 1.47 0.528 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.292 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -80.98 83.97 2.1 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.679 1.586 . . . . 0.0 111.316 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.6 tp -97.23 96.18 8.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.772 0.796 . . . . 0.0 109.028 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -120.37 106.44 11.85 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -175.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.4 m -12.79 111.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -137.81 76.42 1.58 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.75 -168.3 1.55 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.763 0.792 . . . . 0.0 111.252 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -74.93 101.5 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.768 0.794 . . . . 0.0 108.971 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.72 40.41 5.31 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.069 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.589 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 19.9 t -117.38 148.73 43.3 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.59 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 84.2 Cg_exo -55.52 170.93 0.73 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.053 1.835 . . . . 0.0 114.732 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -65.71 161.72 20.09 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.523 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 tp -57.33 -59.21 5.47 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -89.62 79.92 6.74 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.386 1.089 . . . . 0.0 110.636 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.7 p -151.96 154.77 36.72 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -60.0 -39.59 86.29 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -41.43 89.92 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -66.15 -48.68 69.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.64 -33.08 72.27 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.273 -0.892 . . . . 0.0 113.148 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -50.31 64.85 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.419 -0.801 . . . . 0.0 112.291 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -74.08 -33.88 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.0 m -69.56 -39.82 77.16 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -65.96 -29.88 70.35 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.57 -47.21 82.46 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.649 -0.657 . . . . 0.0 111.974 176.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.41 -59.96 2.65 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.991 174.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -35.21 -49.23 0.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -58.66 -55.72 31.43 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -170.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -90.04 90.26 8.06 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.174 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 142.67 -35.06 1.75 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.512 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -14.72 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 -169.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.4 mt -143.09 -70.3 0.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.57 -81.01 0.08 OUTLIER Glycine 0 N--CA 1.467 0.722 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -87.01 83.22 7.54 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -158.15 -29.14 0.08 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.809 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -99.67 52.71 0.93 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.517 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -80.1 -49.54 11.6 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.023 172.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -75.71 -39.32 57.56 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.875 -0.516 . . . . 0.0 112.347 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.2 t -61.96 -43.54 98.63 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.532 -0.73 . . . . 0.0 112.914 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.4 m -68.23 -48.44 65.12 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 120.19 -0.604 . . . . 0.0 112.338 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.15 -41.62 73.6 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.05 -24.55 63.27 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -97.72 -96.62 0.21 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 168.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.59 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.8 t -19.92 -70.08 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 -170.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -94.54 87.05 1.07 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 80.4 p -15.5 -72.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.184 2.661 . . . . 0.0 118.184 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.3 m -82.96 131.55 35.18 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.515 0.674 . . . . 0.0 109.76 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.7 m -73.18 121.58 85.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.95 -178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.84 166.84 16.89 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.705 1.603 . . . . 0.0 111.599 -178.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.27 103.94 9.54 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.54 0.686 . . . . 0.0 110.181 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -91.94 113.76 26.12 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.373 0.606 . . . . 0.0 109.854 -178.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.39 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 121.502 0.668 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -143.27 91.66 6.92 Favored Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -63.63 123.2 11.64 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 121.727 1.618 . . . . 0.0 113.162 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -82.86 113.04 20.21 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -79.8 120.51 24.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.557 0.694 . . . . 0.0 110.614 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.437 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 30.1 p -81.79 111.68 18.24 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.965 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -92.65 73.1 5.04 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.894 0.854 . . . . 0.0 109.513 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.54 167.02 12.53 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.853 0.835 . . . . 0.0 110.494 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.1 -38.22 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.64 2.67 73.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 120.035 -1.078 . . . . 0.0 114.925 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.532 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.5 t -94.54 155.22 39.81 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 118.649 1.224 . . . . 0.0 110.424 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.573 ' HD3' ' SG ' ' A' ' 44' ' ' CYS . 50.4 Cg_exo -67.21 176.47 4.65 Favored 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 121.542 1.494 . . . . 0.0 113.871 -173.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.7 t -72.59 158.47 35.61 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.882 0.849 . . . . 0.0 111.356 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -61.11 -42.55 98.74 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -70.21 -26.85 64.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -175.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -74.51 148.98 40.46 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.866 0.841 . . . . 0.0 111.329 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.03 -19.49 65.7 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -176.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.88 91.3 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.375 -0.828 . . . . 0.0 112.712 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -68.86 -36.91 78.7 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.658 -0.651 . . . . 0.0 112.002 174.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -62.41 -42.25 99.3 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.679 -0.638 . . . . 0.0 112.226 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.33 -46.11 71.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.419 HG13 ' SG ' ' A' ' 44' ' ' CYS . 7.4 p -68.66 -29.56 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.8 p -64.17 -29.85 70.95 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.8 tptp -66.2 -41.88 89.56 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.578 -0.701 . . . . 0.0 111.761 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -64.23 -44.88 90.49 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 112.05 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.27 -31.13 72.12 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.6 tpt180 -63.18 -41.4 99.21 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.536 -0.727 . . . . 0.0 112.516 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -64.86 -36.85 85.67 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.597 -0.689 . . . . 0.0 112.416 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -81.83 126.15 31.53 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.772 0.796 . . . . 0.0 110.444 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.22 -125.76 8.23 Favored Glycine 0 N--CA 1.467 0.74 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.327 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -163.27 -67.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.402 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.49 -52.43 0.71 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.366 -0.533 . . . . 0.0 110.873 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.49 62.42 0.43 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.909 -1.139 . . . . 0.0 111.644 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -156.9 36.13 0.3 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.654 0.74 . . . . 0.0 111.893 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -161.05 -54.36 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -34.5 -42.32 0.14 Allowed 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -62.75 -57.83 9.58 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.583 -0.447 . . . . 0.0 112.02 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -63.04 -48.12 80.09 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.303 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.3 t -37.78 -59.52 0.81 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.36 -29.69 53.48 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.45 -27.28 69.17 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.939 -1.101 . . . . 0.0 113.811 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -97.08 -53.51 3.47 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.622 169.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -77.04 -45.38 27.34 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.488 -0.758 . . . . 0.0 112.935 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.573 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.0 t -77.59 142.92 38.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.938 0.875 . . . . 0.0 111.163 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.52 94.82 0.1 Allowed Glycine 0 CA--C 1.524 0.65 0 C-N-CA 119.898 -1.144 . . . . 0.0 110.629 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.5 m -92.01 88.39 6.55 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.644 0.735 . . . . 0.0 109.9 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.8 m -84.53 -55.0 4.36 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.481 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 76.7 p -75.31 154.25 86.1 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.913 177.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.54 76.16 4.68 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.681 1.587 . . . . 0.0 111.758 -176.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.1 95.84 0.97 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p 169.82 -54.1 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 168.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.149 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.943 -178.868 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -110.86 106.74 57.78 Favored Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.96 102.86 1.14 Allowed 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 121.426 1.417 . . . . 0.0 110.966 -174.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 43.3 tp -91.16 110.54 21.82 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -87.14 179.39 6.66 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.546 1.165 . . . . 0.0 112.025 -169.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.4 t -113.74 122.97 48.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.049 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -142.94 78.02 1.59 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 122.026 0.917 . . . . 0.0 108.56 174.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.423 ' HB1' ' SG ' ' A' ' 40' ' ' CYS . . . -87.0 -168.35 2.21 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.596 0.712 . . . . 0.0 110.848 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.9 mt -76.5 97.03 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.82 0.819 . . . . 0.0 109.038 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.57 47.74 3.4 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.734 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.578 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.2 t -117.3 150.68 46.8 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.578 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.2 Cg_exo -60.94 175.11 1.43 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 121.708 1.605 . . . . 0.0 114.305 -177.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.7 p -72.39 150.33 43.51 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.665 0.745 . . . . 0.0 110.862 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -12.95 62.15 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -77.25 -33.94 55.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.407 -0.808 . . . . 0.0 111.889 174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.2 p -75.84 153.91 36.5 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.022 0.915 . . . . 0.0 111.44 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -67.57 -27.43 66.92 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -47.11 86.96 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.485 -0.759 . . . . 0.0 113.018 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -70.75 -32.53 69.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.07 -34.54 76.48 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.522 -0.736 . . . . 0.0 112.619 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -35.09 79.98 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.531 -0.731 . . . . 0.0 112.887 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.15 -49.15 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 121.748 -0.595 . . . . 0.0 111.023 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -65.29 -29.8 70.6 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -67.29 -27.92 67.58 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 178.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -86.77 -37.83 17.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 118.827 -1.149 . . . . 0.0 112.496 168.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.1 m -66.63 -61.05 2.18 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.06 -1.025 . . . . 0.0 112.125 -178.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -36.89 -45.72 0.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.8 -29.55 64.97 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -176.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -64.57 -53.99 39.2 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.531 -0.731 . . . . 0.0 111.186 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.57 97.6 1.4 Allowed Glycine 0 N--CA 1.467 0.726 0 C-N-CA 119.966 -1.111 . . . . 0.0 112.094 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -145.16 101.02 3.56 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.73 157.27 18.57 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.908 0.861 . . . . 0.0 110.201 -175.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.71 -74.81 1.31 Allowed Glycine 0 N--CA 1.468 0.806 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -90.02 103.86 16.48 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -65.02 114.76 4.8 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -22.05 81.93 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 -169.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -88.17 -12.2 44.62 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -170.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.01 -62.23 1.62 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 118.323 -1.351 . . . . 0.0 108.188 167.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.7 t -43.4 -42.01 4.47 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.423 ' SG ' ' HB1' ' A' ' 8' ' ' ALA . 48.8 t -64.63 -51.35 63.11 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' CG ' ' H ' ' A' ' 42' ' ' GLU . 13.9 pt-20 -68.98 -58.18 4.46 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.581 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.408 ' H ' ' CG ' ' A' ' 41' ' ' GLU . 9.5 tp10 -31.69 -67.92 0.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -91.51 52.73 2.12 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.277 0.561 . . . . 0.0 111.579 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.425 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.3 t -167.54 -58.94 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.28 -0.888 . . . . 0.0 110.241 179.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.13 83.62 0.11 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 28.0 t -92.09 159.97 15.43 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.89 -179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.4 t 169.47 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.781 167.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.2 m -142.31 105.38 5.56 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -58.49 -53.01 4.46 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 121.974 1.782 . . . . 0.0 114.539 -178.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -19.73 104.61 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 95.2 p -87.85 -45.78 10.0 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.22 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.171 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.211 -177.821 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -152.25 151.05 26.81 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.761 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.431 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 79.5 Cg_endo -77.43 164.76 28.31 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 121.78 1.654 . . . . 0.0 111.824 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 3' ' ' PRO . 8.9 tt 170.34 118.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 167.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -98.4 172.17 7.71 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.512 0.673 . . . . 0.0 109.726 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 4.3 t -115.04 114.61 25.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.161 169.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -100.59 75.63 1.76 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.68 0.752 . . . . 0.0 110.44 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -107.21 153.8 22.16 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.575 0.702 . . . . 0.0 109.509 172.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.2 tp -68.08 -39.95 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.63 31.69 6.0 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.499 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.719 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 2.2 t -117.61 152.21 49.38 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.719 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 49.9 Cg_endo -71.19 -175.48 1.52 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.592 1.528 . . . . 0.0 112.882 -174.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -58.83 149.03 27.83 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.767 0.794 . . . . 0.0 112.563 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.5 mt -59.32 -47.02 86.97 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.643 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -85.04 96.06 9.29 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.393 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 p 169.82 162.32 0.06 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 166.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -61.68 -32.85 73.06 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -172.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.13 81.77 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.546 -0.722 . . . . 0.0 112.565 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -67.78 -40.22 83.99 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.654 -0.654 . . . . 0.0 112.442 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.23 -38.97 88.55 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.92 94.56 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.1 t -68.97 -45.42 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 O-C-N 121.771 -0.581 . . . . 0.0 111.377 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.3 p -63.02 -41.59 99.59 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -73.75 -30.93 63.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.57 -51.11 46.23 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.742 -0.599 . . . . 0.0 111.734 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.1 t -76.73 -28.62 55.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.718 -0.793 . . . . 0.0 113.021 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.52 -41.13 84.78 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.621 -0.674 . . . . 0.0 112.271 170.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -63.11 -36.28 83.07 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.74 -0.6 . . . . 0.0 112.523 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -69.87 -54.61 12.67 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.791 -0.568 . . . . 0.0 111.312 176.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' A' ' 31' ' ' LYS . . . -94.81 -109.36 2.24 Favored Glycine 0 N--CA 1.468 0.807 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 57.6 tptt 169.52 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 167.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.5 mt -124.12 127.4 47.74 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.11 -147.91 14.08 Favored Glycine 0 CA--C 1.526 0.753 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.607 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.7 -35.38 65.15 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.229 -0.571 . . . . 0.0 112.513 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -18.37 -56.94 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.544 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 82.1 m-85 -58.86 -25.48 63.33 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -169.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -66.85 -57.58 6.72 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.121 -0.987 . . . . 0.0 111.4 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -68.99 -60.02 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.225 175.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.9 t -48.6 -29.38 4.23 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -172.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.8 m -87.08 -45.74 10.43 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 119.029 -1.069 . . . . 0.0 112.683 170.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.37 -41.31 51.66 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -178.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.44 -56.3 4.65 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.63 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -91.78 67.82 5.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.392 -0.818 . . . . 0.0 111.649 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 46.1 t -167.01 151.04 6.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 122.001 0.905 . . . . 0.0 109.968 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.3 -145.03 6.7 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 119.796 -1.192 . . . . 0.0 110.864 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.7 p -90.95 137.41 32.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.548 0.689 . . . . 0.0 110.302 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.2 m -75.83 -59.34 2.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.376 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -86.52 137.07 34.42 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.72 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.65 115.72 3.67 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.615 1.544 . . . . 0.0 111.071 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.47 118.37 23.71 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.324 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.9 p -149.38 133.58 17.31 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.647 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.174 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.512 -179.5 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -136.45 143.04 41.68 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.51 171.45 18.02 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 121.88 1.72 . . . . 0.0 111.717 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tt -77.92 110.49 12.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -80.57 94.2 6.23 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.772 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.2 t -25.32 120.33 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 117.09 2.255 . . . . 0.0 117.09 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -88.48 79.35 7.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.921 0.867 . . . . 0.0 109.749 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.11 162.09 13.69 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 122.034 0.921 . . . . 0.0 111.038 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -76.2 -66.85 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.093 -176.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.84 60.56 0.46 Allowed Glycine 0 N--CA 1.469 0.882 0 C-N-CA 120.151 -1.023 . . . . 0.0 111.872 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.652 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 13.9 t -117.46 154.77 50.61 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.652 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.9 Cg_exo -58.86 -176.16 0.09 OUTLIER 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.969 1.779 . . . . 0.0 115.464 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.2 m -57.77 144.63 37.68 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.658 0.742 . . . . 0.0 111.636 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.04 -56.5 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.408 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -91.36 68.83 5.91 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.301 1.048 . . . . 0.0 110.71 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.6 p -139.59 160.72 39.21 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.521 0.677 . . . . 0.0 109.254 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.31 -31.42 71.26 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.25 -54.63 9.02 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.58 -0.7 . . . . 0.0 112.004 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -68.95 -29.86 68.18 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -61.86 -39.46 91.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.414 -0.804 . . . . 0.0 112.216 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.19 -36.0 81.94 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 173.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.4 t -63.01 -48.68 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.821 -0.549 . . . . 0.0 111.132 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.8 m -64.79 -29.06 70.02 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 177.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -61.84 -54.2 45.43 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.7 -0.625 . . . . 0.0 112.112 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -73.5 -63.88 1.1 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.924 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.5 m -38.84 -43.08 0.9 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 116.925 2.194 . . . . 0.0 116.925 -174.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -48.1 -29.01 3.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -57.16 -31.89 65.85 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -177.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -132.88 121.38 22.8 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.603 -0.686 . . . . 0.0 109.591 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.24 22.09 2.18 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 120.626 -0.797 . . . . 0.0 114.612 175.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -17.72 -72.35 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -172.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.12 165.34 28.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.865 0.84 . . . . 0.0 110.62 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.44 -80.04 1.29 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 120.182 -1.009 . . . . 0.0 110.674 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.11 86.63 4.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.81 118.3 10.13 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -29.17 84.37 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -94.76 -15.05 24.14 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.681 -1.145 . . . . 0.0 114.073 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -87.23 -33.4 19.32 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 118.833 -1.147 . . . . 0.0 112.465 169.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.82 -47.25 85.45 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.377 -0.827 . . . . 0.0 112.606 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.8 m -77.45 -43.6 31.84 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -68.12 -39.77 82.66 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.586 -0.696 . . . . 0.0 112.774 -177.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -71.77 -45.83 60.34 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.662 -0.649 . . . . 0.0 112.352 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -79.47 -77.51 0.18 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.434 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.494 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 49.4 t -19.39 -70.31 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -170.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.27 94.46 1.98 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.668 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.6 m -76.98 106.34 8.6 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.585 0.707 . . . . 0.0 110.321 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 78.5 m -92.12 -59.45 2.1 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.336 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -146.17 142.85 18.11 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.87 125.97 20.85 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.062 1.841 . . . . 0.0 113.789 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -81.3 112.4 18.57 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.489 0.661 . . . . 0.0 110.193 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.1 p -152.68 133.69 14.13 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.583 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.527 -179.178 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 121.476 0.655 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -86.73 145.86 39.97 Favored Pre-proline 0 N--CA 1.471 0.599 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.295 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.09 70.59 5.97 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.573 1.515 . . . . 0.0 112.591 -172.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.2 tp -96.62 104.82 16.84 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -78.66 156.64 28.91 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.07 0.938 . . . . 0.0 110.804 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' HG11 ' A' ' 22' ' ' VAL . 4.7 m -67.79 139.64 56.62 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.018 0.913 . . . . 0.0 111.77 178.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -149.4 77.97 1.36 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 173.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.14 -179.35 5.06 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.8 0.81 . . . . 0.0 110.908 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.2 tt -65.06 -38.05 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.38 46.96 1.04 Allowed Glycine 0 CA--C 1.529 0.946 0 C-N-CA 120.239 -0.981 . . . . 0.0 112.003 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 48.5 t -117.27 145.55 36.22 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 169.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.554 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 91.3 Cg_exo -50.19 150.5 10.56 Favored 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.264 1.976 . . . . 0.0 114.815 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.7 t -78.4 -178.5 5.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.896 0.855 . . . . 0.0 111.859 -173.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.8 -42.67 89.62 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -85.76 70.21 10.67 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.887 0.851 . . . . 0.0 110.216 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -159.6 141.11 12.94 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.7 -34.62 77.53 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.74 -38.54 89.4 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -67.11 -29.13 68.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.95 -38.77 89.74 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.246 -0.909 . . . . 0.0 111.887 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.77 72.63 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.468 HG11 ' SG ' ' A' ' 6' ' ' CYS . 65.0 t -69.69 -47.08 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.603 -0.686 . . . . 0.0 110.985 175.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.7 t -63.45 -34.07 76.94 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.281 -0.568 . . . . 0.0 112.422 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.92 -36.64 70.43 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.007 -1.058 . . . . 0.0 112.377 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -76.68 -55.42 5.52 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.8 -0.562 . . . . 0.0 111.756 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.2 m -77.82 -52.21 9.27 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -60.41 -26.68 66.88 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -49.0 -29.92 5.43 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -63.88 -60.24 3.52 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.383 -0.823 . . . . 0.0 111.083 173.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.76 92.18 2.23 Favored Glycine 0 N--CA 1.468 0.81 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.996 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -157.41 125.09 5.33 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.423 ' CD1' ' H ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -81.77 166.74 19.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.978 0.894 . . . . 0.0 112.28 -175.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.77 -113.47 4.73 Favored Glycine 0 N--CA 1.466 0.699 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -142.57 47.6 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.71 0.766 . . . . 0.0 110.707 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -93.19 4.7 53.54 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -99.98 -8.44 23.9 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.349 -0.941 . . . . 0.0 113.165 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -35.97 -55.06 0.76 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.73 -38.33 70.48 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -63.61 -38.87 92.76 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.589 -0.694 . . . . 0.0 112.796 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -64.48 -47.42 79.02 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.37 -30.55 66.28 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.44 -62.04 1.7 Allowed 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.468 -0.77 . . . . 0.0 110.344 177.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -85.58 97.27 9.98 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.498 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.2 t 171.91 148.37 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 169.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.57 146.1 33.73 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 120.161 -1.018 . . . . 0.0 111.863 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.3 p -140.17 -64.23 0.48 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.848 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.5 m -76.69 123.61 26.41 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 177.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.2 m -14.25 97.1 0.04 OUTLIER Pre-proline 0 N--CA 1.481 1.12 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -168.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -84.73 105.07 0.97 Allowed 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 121.498 1.465 . . . . 0.0 110.824 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.43 110.82 18.49 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.045 -0.662 . . . . 0.0 110.278 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 t -92.01 105.28 17.56 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.629 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.171 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.548 -178.908 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -123.28 100.25 39.28 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.3 85.51 1.19 Allowed 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 121.549 1.499 . . . . 0.0 111.068 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.9 tp -147.88 72.56 1.23 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.276 1.036 . . . . 0.0 108.809 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.598 ' HB3' HD22 ' A' ' 19' ' ' ASN . 76.1 m-85 -105.21 95.09 5.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.257 -174.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -8.71 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -125.59 76.45 1.57 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.861 -172.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.94 -172.99 2.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.774 169.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.92 102.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 122.192 0.996 . . . . 0.0 109.85 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.39 -82.98 0.25 Allowed Glycine 0 N--CA 1.467 0.748 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.45 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.89 145.21 0.07 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -174.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.507 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 74.8 Cg_exo -58.18 162.96 10.7 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 121.927 1.751 . . . . 0.0 114.784 -174.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.5 t -67.02 165.52 15.53 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.636 0.731 . . . . 0.0 111.526 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.08 -54.64 44.7 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.867 -0.52 . . . . 0.0 112.323 -174.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -87.83 79.47 8.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.911 0.862 . . . . 0.0 110.409 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.1 p -153.28 149.88 28.37 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.38 -40.2 89.98 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.48 77.95 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.598 HD22 ' HB3' ' A' ' 5' ' ' TYR . 26.0 t30 -64.28 -33.64 76.29 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.9 -41.72 96.64 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 111.908 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.93 92.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 175.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.439 HG22 ' SG ' ' A' ' 44' ' ' CYS . 67.5 t -66.41 -52.24 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 O-C-N 121.753 -0.592 . . . . 0.0 111.431 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.8 t -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -55.21 -42.12 72.92 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.148 -0.97 . . . . 0.0 112.528 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -76.19 -54.06 7.36 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.807 -0.558 . . . . 0.0 112.137 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.87 -38.42 45.98 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -173.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -67.93 -27.92 67.04 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -86.69 -61.16 1.8 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 118.884 -1.127 . . . . 0.0 111.443 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -92.2 118.79 31.2 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 0.0 109.937 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.14 36.8 5.6 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.359 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -92.91 70.69 4.68 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.757 -0.849 . . . . 0.0 109.311 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.8 mt -138.39 44.7 2.1 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.134 -176.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 80.44 -84.49 1.37 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.146 -1.026 . . . . 0.0 112.838 174.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.65 87.96 7.32 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 122.202 1.001 . . . . 0.0 109.867 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -166.32 -38.09 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.04 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.536 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 97.6 m-85 -72.52 -26.83 61.91 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -65.64 -49.55 68.28 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.167 -0.958 . . . . 0.0 111.356 177.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -68.19 -32.44 72.68 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.7 t -69.45 -47.1 65.1 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.386 -0.821 . . . . 0.0 112.585 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.536 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 5.6 m -71.69 -41.09 69.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.425 -0.797 . . . . 0.0 112.254 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -78.91 -29.5 44.25 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -99.04 -60.49 1.52 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.291 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -69.97 -71.04 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.498 -172.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.507 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 50.3 t -18.86 -72.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 -172.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.46 83.53 0.46 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -87.11 121.66 29.87 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.535 0.683 . . . . 0.0 110.1 -177.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 69.1 p -71.86 -47.1 55.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.9 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -137.03 94.15 12.83 Favored Pre-proline 0 N--CA 1.469 0.503 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -81.73 105.59 1.56 Allowed 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.565 1.51 . . . . 0.0 110.921 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.33 117.35 22.94 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.325 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.6 p -148.07 -62.65 0.26 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.289 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.171 179.494 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -91.69 133.35 31.08 Favored Pre-proline 0 N--CA 1.47 0.555 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -82.38 85.84 1.59 Allowed 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 121.579 1.519 . . . . 0.0 111.491 -174.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 tt -96.3 106.39 18.6 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -135.52 109.09 7.94 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.9 m -13.06 118.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -146.39 83.73 1.62 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 170.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.28 -153.76 0.16 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.519 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.7 mm -71.83 -58.88 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.275 -0.89 . . . . 0.0 110.782 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -76.86 -55.9 4.31 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.836 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.609 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.68 139.28 0.16 Allowed Pre-proline 0 N--CA 1.477 0.881 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -170.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.631 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 39.6 Cg_endo -67.43 176.95 4.31 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 121.738 1.625 . . . . 0.0 113.431 -173.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.3 p -74.12 153.29 39.64 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.656 0.741 . . . . 0.0 111.265 -175.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.498 ' H ' HD12 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -71.14 -3.64 21.06 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.214 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -97.31 -19.08 18.77 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.446 -0.784 . . . . 0.0 112.915 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -75.84 146.69 39.67 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.205 -0.934 . . . . 0.0 110.932 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.02 -41.46 71.38 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -172.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.01 76.91 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -71.25 -35.33 71.37 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.75 -30.44 70.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.246 -0.909 . . . . 0.0 112.893 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.09 33.1 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.26 -0.9 . . . . 0.0 112.051 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.0 p -67.64 -39.67 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.6 p -75.88 -35.55 59.83 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -176.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -66.48 -29.79 69.98 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.81 -52.29 66.08 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.469 -0.769 . . . . 0.0 112.223 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.9 m -76.94 -31.75 56.84 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -66.36 -43.67 85.35 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.994 -1.066 . . . . 0.0 112.257 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -67.62 -43.88 79.36 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.66 -0.65 . . . . 0.0 112.149 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -120.95 100.15 6.91 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -53.97 0.31 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 119.89 -1.148 . . . . 0.0 111.309 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -15.04 100.17 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.6 tp -160.86 -62.27 0.06 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.918 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.37 -68.46 0.29 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.127 -1.189 . . . . 0.0 110.127 -174.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 19.4 m-20 -85.49 85.12 7.45 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.482 ' HD2' ' NE ' ' A' ' 38' ' ' ARG . 38.8 t70 172.86 11.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.2 168.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.481 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 95.9 m-85 -101.3 -29.79 11.86 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.581 -1.324 . . . . 0.0 112.295 169.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -70.23 -50.04 43.93 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.149 -0.969 . . . . 0.0 110.918 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.482 ' NE ' ' HD2' ' A' ' 35' ' ' ASP . 38.3 ptt180 -67.68 -39.65 84.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.4 t -65.46 -43.89 88.91 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.485 -0.76 . . . . 0.0 113.051 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.481 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 73.5 m -63.69 -62.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.853 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -42.33 -62.65 0.91 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -174.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -36.95 -62.15 0.51 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -173.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -91.74 -12.15 34.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.631 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.9 t -147.56 128.33 14.33 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.136 -0.977 . . . . 0.0 110.522 -174.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.3 -104.58 3.12 Favored Glycine 0 N--CA 1.466 0.698 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.464 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.4 m -88.15 87.15 7.23 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.72 0.771 . . . . 0.0 109.4 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 66.4 p -77.78 121.51 24.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.528 0.68 . . . . 0.0 110.741 -173.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.5 p -95.57 119.92 64.4 Favored Pre-proline 0 N--CA 1.47 0.567 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -58.35 124.58 16.2 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 121.894 1.729 . . . . 0.0 113.619 -178.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.82 131.14 7.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.476 0.655 . . . . 0.0 109.317 179.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.8 p -89.73 94.9 10.01 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.041 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.547 -179.06 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 CA-C-O 121.674 0.75 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -78.59 149.21 74.52 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.559 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -77.66 -35.87 1.38 Allowed 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 121.69 1.594 . . . . 0.0 114.042 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.8 tp -14.22 100.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -94.37 161.43 14.24 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.858 0.837 . . . . 0.0 110.215 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 t -82.5 85.29 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -124.8 77.26 1.59 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.014 -0.675 . . . . 0.0 110.199 -171.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.08 -106.16 0.11 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.629 -0.829 . . . . 0.0 109.451 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.5 mm -90.41 -69.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -171.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.78 -50.98 4.2 Favored Glycine 0 N--CA 1.47 0.923 0 C-N-CA 120.126 -1.035 . . . . 0.0 113.71 -172.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t -20.85 133.87 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -170.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.721 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 71.2 Cg_exo -54.43 170.98 0.46 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.329 2.019 . . . . 0.0 114.941 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -61.68 164.81 5.67 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 122.123 0.963 . . . . 0.0 112.698 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -171.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -99.61 52.05 0.93 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.781 -174.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.2 p -108.21 166.36 10.8 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.778 0.799 . . . . 0.0 110.178 176.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.32 -44.62 78.71 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.423 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.17 81.18 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -65.46 -29.8 70.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.7 -41.46 90.8 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.407 -0.808 . . . . 0.0 113.124 -178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.03 69.74 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.562 -0.711 . . . . 0.0 112.817 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.8 p -70.01 -39.79 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.5 p -66.36 -21.95 66.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -82.48 -23.34 34.76 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 171.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -85.64 -49.73 7.77 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.47 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.94 -28.34 64.41 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -67.44 -26.05 66.21 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.954 -1.091 . . . . 0.0 113.279 171.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -84.08 -44.22 14.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 118.852 -1.139 . . . . 0.0 111.117 168.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -85.21 71.76 10.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.222 -0.924 . . . . 0.0 109.189 171.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -132.64 125.1 4.04 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -83.98 -101.48 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.022 -0.671 . . . . 0.0 109.432 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.7 mt -140.4 76.19 1.54 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.77 -44.73 3.39 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 119.923 -1.132 . . . . 0.0 113.843 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.455 ' CG ' ' H ' ' A' ' 35' ' ' ASP . 10.5 p-10 -68.18 -69.03 0.35 Allowed 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.985 -0.715 . . . . 0.0 111.914 -174.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.455 ' H ' ' CG ' ' A' ' 34' ' ' ASP . 13.3 t70 -19.47 -67.1 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 -173.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -35.32 -47.37 0.41 Allowed 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -174.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -35.39 -53.65 0.65 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -175.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -66.4 -61.21 2.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.444 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.8 t -37.07 -49.13 0.84 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.1 m -72.49 -35.63 68.21 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -175.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -72.35 -48.55 41.03 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.294 -0.879 . . . . 0.0 111.323 175.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -81.44 -96.27 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -34.14 -53.2 0.48 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -173.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.721 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 43.5 t -69.67 -60.71 2.15 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.78 -132.38 5.62 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.773 -176.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 81.3 p -156.93 143.46 18.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.576 0.703 . . . . 0.0 109.547 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.6 p -137.86 131.83 31.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.644 0.735 . . . . 0.0 109.068 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.4 t -87.77 138.33 31.44 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.878 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.97 98.47 1.12 Allowed 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 121.635 1.557 . . . . 0.0 110.996 -177.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.63 112.57 2.44 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -15.86 108.1 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 -169.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.28 179.434 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.47 124.79 56.28 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.231 -0.587 . . . . 0.0 109.544 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.401 ' HG2' ' H ' ' A' ' 4' ' ' LEU . 73.3 Cg_endo -81.45 -48.21 0.06 OUTLIER 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.582 1.521 . . . . 0.0 112.559 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.401 ' H ' ' HG2' ' A' ' 3' ' ' PRO . 32.5 tp -15.3 107.57 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 117.734 2.494 . . . . 0.0 117.734 -169.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -99.36 139.24 35.31 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.962 175.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.8 t -83.92 93.72 8.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.712 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -97.76 78.51 2.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.833 0.825 . . . . 0.0 109.234 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 155.54 32.28 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.636 0.732 . . . . 0.0 110.762 177.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.59 110.63 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 121.871 0.843 . . . . 0.0 109.9 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.3 -42.39 1.82 Allowed Glycine 0 CA--C 1.53 1.013 0 C-N-CA 120.237 -0.982 . . . . 0.0 112.001 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.2 m -80.74 169.47 19.39 Favored Pre-proline 0 CA--C 1.542 0.645 0 O-C-N 122.096 -0.649 . . . . 0.0 110.71 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -58.63 152.84 53.03 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 121.877 1.718 . . . . 0.0 115.44 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -76.68 164.43 25.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.556 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.1 tp -50.29 -50.4 50.56 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -173.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -90.84 36.75 0.91 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.737 -0.785 . . . . 0.0 112.834 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.6 p -109.98 151.25 27.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.954 0.883 . . . . 0.0 110.451 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.33 -33.54 75.74 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.64 -55.68 24.75 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.718 -0.613 . . . . 0.0 111.215 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -37.92 -40.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -177.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.9 mp -54.13 -38.41 65.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.46 -43.42 66.68 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p -65.23 -22.75 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -82.42 -55.19 4.65 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 118.224 -1.39 . . . . 0.0 109.493 167.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -36.14 -54.98 0.79 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -175.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.93 -46.42 24.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -177.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.4 m -63.07 -50.24 71.37 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.548 -0.72 . . . . 0.0 112.385 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -55.85 -32.68 63.84 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.8 -29.31 68.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 175.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -76.04 95.33 3.59 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.67 0.748 . . . . 0.0 110.043 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.41 -130.61 9.95 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.468 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -163.76 -56.19 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.331 -0.548 . . . . 0.0 109.964 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.2 tp -145.38 111.75 5.74 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.75 -167.08 37.23 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.719 -1.229 . . . . 0.0 111.846 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -89.49 15.37 9.43 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.15 -27.93 57.18 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.232 -0.918 . . . . 0.0 112.614 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.451 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 22.6 m-85 -71.6 -24.74 61.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -172.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.34 -49.3 77.51 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.416 -0.803 . . . . 0.0 112.072 -177.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -63.45 -39.2 93.85 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.675 -0.641 . . . . 0.0 112.455 176.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.0 t -61.47 -44.95 96.18 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 4.4 m -73.69 -29.21 62.15 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.95 -26.85 66.32 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 172.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -92.39 -98.91 0.13 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 167.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -36.57 112.85 0.2 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 52.7 t -158.79 -63.18 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.268 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.94 -88.68 0.07 OUTLIER Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 80.6 p -86.19 90.4 8.13 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.806 0.812 . . . . 0.0 109.172 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -144.86 -62.93 0.36 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.9 t -85.08 136.09 38.71 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 120.194 -0.602 . . . . 0.0 109.942 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.51 107.82 2.21 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 121.675 1.583 . . . . 0.0 111.043 -176.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.07 -55.94 4.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.723 -178.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.6 m -15.57 109.45 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -169.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.732 179.088 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -123.39 94.11 47.02 Favored Pre-proline 0 N--CA 1.47 0.565 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.401 ' O ' ' C ' ' A' ' 4' ' ' LEU . 79.5 Cg_endo -82.73 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.532 0.388 0 C-N-CA 121.642 1.561 . . . . 0.0 110.437 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 3' ' ' PRO . 44.2 tp -15.76 109.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -169.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -84.18 85.86 7.3 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.809 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -26.14 121.18 0.07 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.578 2.066 . . . . 0.0 116.578 -175.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -89.36 78.97 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.749 0.785 . . . . 0.0 109.852 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.83 154.51 35.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.69 0.757 . . . . 0.0 110.144 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.4 mm -81.03 99.86 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-O 121.667 0.746 . . . . 0.0 109.937 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.81 -82.65 0.15 Allowed Glycine 0 N--CA 1.467 0.726 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.634 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.8 t -35.19 150.75 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -171.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.634 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 87.9 Cg_exo -55.87 -173.29 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.4 2.067 . . . . 0.0 116.541 -174.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.7 m -50.91 146.33 6.17 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.436 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.6 tp -55.8 -51.91 65.83 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -100.08 81.9 2.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.694 0.759 . . . . 0.0 109.282 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -143.67 171.27 14.42 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.842 0.829 . . . . 0.0 110.341 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -67.58 -43.0 81.65 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.761 -0.587 . . . . 0.0 112.36 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.57 -45.21 80.05 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.733 -0.604 . . . . 0.0 112.462 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.7 -31.53 72.59 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.3 tp -64.32 -41.7 96.68 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.297 -0.877 . . . . 0.0 112.297 175.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.23 76.46 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.636 -0.665 . . . . 0.0 112.785 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.577 HG13 ' SG ' ' A' ' 11' ' ' CYS . 14.6 p -62.72 -41.43 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.691 -0.631 . . . . 0.0 112.396 178.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.9 p -66.43 -29.93 70.18 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -67.06 -28.61 68.34 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -86.71 -63.21 1.35 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 118.293 -1.363 . . . . 0.0 109.76 167.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.44 ' SG ' HG23 ' A' ' 22' ' ' VAL . 73.1 m -37.25 -47.84 0.83 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.378 1.992 . . . . 0.0 116.378 -174.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -51.76 -29.16 17.64 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -57.31 -29.31 63.82 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -71.34 176.19 4.8 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.96 0.886 . . . . 0.0 110.662 175.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.4 120.02 17.78 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 120.392 -0.909 . . . . 0.0 113.298 -174.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 ttmt -84.52 95.69 8.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.698 0.761 . . . . 0.0 110.084 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -113.1 -45.27 3.18 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.95 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.36 -89.12 0.08 OUTLIER Glycine 0 CA--C 1.523 0.575 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -101.21 44.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.676 0.751 . . . . 0.0 110.376 172.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -96.39 3.63 52.75 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.606 -0.684 . . . . 0.0 112.54 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -99.68 -1.65 37.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.695 169.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -34.05 -54.3 0.48 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -68.29 -57.46 5.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.02 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 23.0 t -40.02 -38.46 0.72 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 117.571 2.434 . . . . 0.0 117.571 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.3 m -90.18 -24.63 20.97 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 172.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -86.22 -25.71 25.46 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -96.58 -46.89 6.15 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.149 -0.969 . . . . 0.0 112.139 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -99.18 71.03 1.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 118.993 -1.083 . . . . 0.0 110.719 170.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.588 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.7 t 169.46 -74.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 166.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.52 79.15 1.44 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.39 -178.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.6 p -148.49 112.53 5.18 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 64.2 p -13.89 106.09 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.6 m -143.62 96.68 5.61 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -83.13 103.34 1.15 Allowed 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 121.541 1.494 . . . . 0.0 110.864 -175.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.98 104.44 14.05 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.569 0.7 . . . . 0.0 110.305 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 78.8 p -89.79 -58.24 2.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.209 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.203 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.312 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.475 0.805 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -82.72 155.04 68.44 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.986 178.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -79.59 82.36 2.52 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 121.657 1.572 . . . . 0.0 110.967 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.0 tp -157.0 113.31 2.98 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.584 0.707 . . . . 0.0 109.276 -177.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.15 147.87 26.4 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.3 t -85.22 107.56 17.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.058 -173.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -99.92 80.65 2.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.696 0.76 . . . . 0.0 109.447 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.59 -149.28 0.25 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.603 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.51 111.6 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 169.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.84 38.0 6.65 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.414 -0.898 . . . . 0.0 113.337 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.654 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.6 t -117.93 153.22 50.96 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.654 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -56.49 175.75 0.25 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.093 1.862 . . . . 0.0 114.852 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 75.3 p -59.93 149.21 32.43 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.592 0.71 . . . . 0.0 111.461 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.84 -47.03 77.98 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -171.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.16 0.1 46.82 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -177.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -73.12 161.12 30.99 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.902 -1.124 . . . . 0.0 111.626 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -67.63 -33.16 74.42 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.08 -43.57 86.96 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.591 -0.693 . . . . 0.0 112.53 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -66.96 -36.55 82.45 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.644 -0.66 . . . . 0.0 112.313 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.72 -42.63 99.75 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.67 -0.644 . . . . 0.0 111.701 175.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.32 -43.18 99.41 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.79 -37.49 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.55 -0.719 . . . . 0.0 112.469 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -64.01 -35.11 79.65 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.531 -0.731 . . . . 0.0 112.096 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -57.36 -40.56 78.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -68.39 -63.95 0.96 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.528 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.0 m -41.97 -43.48 3.15 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.1 -28.77 69.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -178.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -57.97 -26.24 62.06 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.56 -49.75 76.54 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.72 -0.613 . . . . 0.0 112.054 176.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 133.96 83.79 0.21 Allowed Glycine 0 N--CA 1.468 0.82 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 178.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -14.2 100.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -168.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -89.56 -53.6 4.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.628 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.71 -73.76 0.41 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 -171.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -86.64 73.41 10.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.42 1.105 . . . . 0.0 109.895 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -157.52 -41.59 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.168 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -65.81 -31.75 72.88 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.76 -52.43 56.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.564 -0.71 . . . . 0.0 111.48 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -68.55 -38.36 80.72 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.699 -0.626 . . . . 0.0 112.606 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -55.79 -52.98 62.09 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.8 m -77.86 -33.62 52.08 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -62.06 -28.58 69.71 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -95.87 -35.34 11.51 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 119.102 -1.039 . . . . 0.0 112.538 171.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.9 -78.6 0.1 Allowed 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.205 -0.935 . . . . 0.0 110.126 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.561 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 33.9 t -18.8 -70.3 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.338 2.347 . . . . 0.0 117.338 -173.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -107.27 -84.07 1.64 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.6 p 169.22 69.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 166.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 62.7 m -100.88 139.44 36.56 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 57.7 m -133.81 99.82 13.73 Favored Pre-proline 0 N--CA 1.469 0.523 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.99 110.24 2.05 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.532 1.488 . . . . 0.0 110.916 -174.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.9 120.46 4.2 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 90.6 p -89.91 119.49 30.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.056 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.576 -179.051 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.74 141.2 14.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -55.23 111.98 0.91 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.214 1.942 . . . . 0.0 114.283 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp -151.51 101.57 2.82 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -97.0 131.4 43.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.825 0.822 . . . . 0.0 110.065 -170.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 23' ' ' SER . 28.8 p -85.82 100.17 11.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.843 -172.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -98.63 85.78 3.42 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 172.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.96 -148.21 0.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.81 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.8 mt -116.67 100.96 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 169.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 140.99 -54.13 0.64 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.217 -0.992 . . . . 0.0 110.686 -173.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.603 ' SG ' HG23 ' A' ' 22' ' ' VAL . 5.0 t -77.76 161.52 71.28 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.297 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.589 ' CD ' ' SG ' ' A' ' 11' ' ' CYS . 52.1 Cg_exo -71.16 -174.67 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 CA-C-N 120.816 1.327 . . . . 0.0 114.352 -169.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -73.44 146.77 44.76 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.512 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -18.97 64.59 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -175.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -72.61 -31.17 64.97 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.47 -0.769 . . . . 0.0 112.357 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.0 p -73.75 149.28 41.88 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.739 0.781 . . . . 0.0 111.29 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -67.52 -24.26 65.54 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.28 -43.72 98.18 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.55 -0.718 . . . . 0.0 112.717 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -73.79 -29.4 62.15 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.944 -0.702 . . . . 0.0 112.301 177.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.8 -43.47 98.73 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.353 -0.842 . . . . 0.0 112.591 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.42 -42.68 82.82 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.603 HG23 ' SG ' ' A' ' 11' ' ' CYS . 30.1 m -68.76 -25.3 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.519 ' HB2' ' SG ' ' A' ' 6' ' ' CYS . 10.4 t -85.59 -26.91 25.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 118.848 -1.141 . . . . 0.0 113.19 168.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -50.42 -44.07 55.13 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.393 0.997 . . . . 0.0 113.257 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.02 -62.0 1.74 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.752 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.4 m -44.43 -34.39 2.02 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -85.35 -39.43 17.65 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 172.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -66.15 -57.97 6.46 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.997 -1.065 . . . . 0.0 110.761 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -108.6 88.44 2.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.04 -60.19 0.28 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 119.24 -1.457 . . . . 0.0 112.764 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -15.26 111.15 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -168.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -154.33 -51.89 0.09 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.146 -0.621 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.26 -72.21 0.25 Allowed Glycine 0 N--CA 1.466 0.683 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -174.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -67.74 -50.14 58.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.781 173.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -18.91 -57.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -53.03 -54.41 35.71 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -172.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -38.89 -61.49 0.73 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -72.89 -36.96 67.44 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -54.1 -51.43 64.22 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.0 m -77.19 -52.59 8.98 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.409 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -54.7 -37.26 65.62 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -69.54 -56.73 6.53 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.526 -0.734 . . . . 0.0 110.982 175.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.57 56.22 3.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.761 -0.587 . . . . 0.0 111.649 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.406 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.4 t -166.75 -61.73 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.49 -0.756 . . . . 0.0 109.761 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.23 83.17 0.16 Allowed Glycine 0 N--CA 1.466 0.654 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 178.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.6 t -92.1 129.67 38.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.629 0.728 . . . . 0.0 110.949 -173.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 74.1 p -72.71 -38.76 67.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.777 175.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 77.3 m -133.19 96.83 17.03 Favored Pre-proline 0 N--CA 1.469 0.518 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -60.15 150.2 80.68 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.997 1.798 . . . . 0.0 114.084 -175.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.26 -65.5 0.17 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.0 177.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.0 m -88.96 144.62 26.05 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.589 0.709 . . . . 0.0 110.234 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.327 179.529 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 111.434 0.161 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.42 ' HD2' ' NZ ' ' A' ' 31' ' ' LYS . 60.5 m-20 -137.68 145.28 48.11 Favored Pre-proline 0 N--CA 1.471 0.623 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -74.74 122.11 7.11 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 121.779 1.653 . . . . 0.0 110.713 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 tt -145.88 105.85 4.01 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -94.29 142.13 27.76 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.861 0.838 . . . . 0.0 109.01 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.48 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 11.9 t -76.63 135.1 39.15 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.934 -171.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -89.36 83.28 6.41 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.22 143.26 33.19 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.697 0.761 . . . . 0.0 110.013 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.5 pt -73.85 -24.73 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.49 60.49 0.54 Allowed Glycine 0 N--CA 1.469 0.86 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.926 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.708 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 15.1 t -116.93 156.0 48.63 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 169.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.708 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 85.0 Cg_exo -59.9 -179.71 0.23 Allowed 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.801 1.667 . . . . 0.0 115.535 -174.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -62.58 163.78 8.5 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.79 0.805 . . . . 0.0 112.612 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.5 tp -57.68 -50.72 72.25 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -171.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -94.35 50.29 1.36 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.999 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.9 p -112.85 169.53 8.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.833 0.825 . . . . 0.0 110.296 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.03 -40.97 78.29 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.135 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.5 -44.05 75.56 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -64.52 -33.08 75.06 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.52 -41.21 89.17 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.507 -0.745 . . . . 0.0 112.159 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.26 -62.21 1.5 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.58 -0.7 . . . . 0.0 111.317 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.411 HG13 ' SG ' ' A' ' 11' ' ' CYS . 12.1 p -42.19 -46.21 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -174.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -71.25 -40.4 71.02 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -63.25 -38.04 89.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.79 -63.92 0.96 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.421 -0.799 . . . . 0.0 109.769 176.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -44.3 -40.07 4.99 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -56.89 -46.72 81.71 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -67.57 -57.92 5.61 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.772 -0.58 . . . . 0.0 111.143 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -96.5 82.27 3.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 141.55 40.23 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 120.22 -0.991 . . . . 0.0 112.934 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.42 ' NZ ' ' HD2' ' A' ' 2' ' ' ASP . 24.4 tptm -87.45 81.79 7.71 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.998 -0.707 . . . . 0.0 109.163 178.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -138.24 -58.62 0.64 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.722 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.04 -68.86 0.5 Allowed Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -172.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -89.8 78.6 6.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 122.455 1.121 . . . . 0.0 108.867 175.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -161.14 -56.98 0.05 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.48 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 90.8 m-85 -38.78 -40.43 0.62 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -174.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -57.96 -47.56 82.57 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -67.78 -41.32 83.44 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.65 -0.656 . . . . 0.0 112.116 176.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -59.39 -45.64 90.9 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 22.6 m -77.22 -40.72 44.02 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -175.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -68.2 -29.82 68.77 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -68.97 -48.7 62.52 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.392 -0.817 . . . . 0.0 111.84 178.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.62 -57.16 3.45 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.805 -0.559 . . . . 0.0 110.967 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 42.6 t -85.59 148.19 26.04 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 122.016 0.912 . . . . 0.0 111.34 -176.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.42 74.57 1.29 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.738 178.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.1 t -92.01 -65.51 1.0 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.575 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 29.5 m -14.3 105.1 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 -169.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.7 t 169.52 136.99 0.06 OUTLIER Pre-proline 0 N--CA 1.477 0.907 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 166.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -54.81 122.84 12.36 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.017 1.812 . . . . 0.0 113.619 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.96 125.3 5.1 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.8 t -16.33 -72.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -169.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.145 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.163 -176.955 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 121.465 0.65 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -154.4 148.03 18.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.46 93.38 1.08 Allowed 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 121.784 1.656 . . . . 0.0 111.065 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.0 tp -152.7 116.54 4.82 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -131.19 165.4 23.42 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.39 137.47 56.9 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.32 -0.862 . . . . 0.0 111.665 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -131.71 76.92 1.74 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 171.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -94.64 -176.49 3.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.922 0.868 . . . . 0.0 111.048 -176.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.9 mm -71.39 -56.68 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.765 -0.585 . . . . 0.0 111.113 -175.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.59 33.94 5.83 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 120.021 -1.085 . . . . 0.0 113.997 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.599 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.9 t -116.87 160.4 36.95 Favored Pre-proline 0 CA--C 1.543 0.682 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.599 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.1 Cg_exo -67.61 -178.32 1.51 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 CA-C-N 121.082 1.422 . . . . 0.0 114.099 -171.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.3 t -66.23 158.39 29.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.725 0.774 . . . . 0.0 111.594 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.57 -55.23 37.51 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.346 -173.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.41 80.44 8.13 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.927 0.87 . . . . 0.0 110.24 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.9 p -153.81 153.85 32.89 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.549 0.69 . . . . 0.0 109.396 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.42 -36.47 84.27 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -48.5 73.26 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.667 -0.645 . . . . 0.0 112.256 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -63.17 -37.23 86.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.721 -0.612 . . . . 0.0 112.605 175.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.17 -44.17 95.25 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.895 -0.503 . . . . 0.0 111.727 178.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.96 -39.15 93.82 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.653 0.982 . . . . 0.0 113.653 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.0 t -59.6 -49.56 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 O-C-N 121.64 -0.662 . . . . 0.0 111.196 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 95.0 p -66.0 -30.4 70.94 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -61.85 -28.41 69.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -88.25 -55.35 3.78 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 118.769 -1.172 . . . . 0.0 112.896 169.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.7 m -77.99 -47.07 19.36 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -171.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -57.71 -29.37 64.65 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.59 -28.01 65.18 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -77.55 93.27 4.15 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.488 -0.757 . . . . 0.0 110.05 177.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.59 -133.37 11.63 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 119.959 -1.115 . . . . 0.0 111.065 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -164.75 -56.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.094 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -78.28 152.72 32.34 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 122.013 0.911 . . . . 0.0 111.523 -171.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.1 71.9 2.31 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.188 -1.006 . . . . 0.0 113.063 -175.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -141.43 55.86 1.52 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 122.256 1.027 . . . . 0.0 108.424 170.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -174.16 -41.77 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.333 -174.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -68.35 -22.56 64.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -31.31 -51.25 0.18 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -173.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -61.49 -63.53 1.24 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.582 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 14.5 t -38.73 -49.9 1.62 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 17.0 t -68.81 -27.46 65.88 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -87.13 -61.66 1.67 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.019 166.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -28.52 -63.73 0.1 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -88.0 -50.94 6.09 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.465 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.517 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 51.4 t -75.01 118.68 18.24 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 122.146 0.974 . . . . 0.0 110.841 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.13 65.45 1.59 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.381 -0.914 . . . . 0.0 111.174 -174.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.5 t -16.04 -78.93 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 -168.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.5 m -13.55 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 -168.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.5 t -160.53 140.94 8.58 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.506 -178.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.05 121.66 6.3 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 121.764 1.643 . . . . 0.0 110.887 179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.7 -54.09 6.46 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.111 -0.636 . . . . 0.0 111.802 -178.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.9 p -85.87 135.01 33.87 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.6 0.714 . . . . 0.0 110.5 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.336 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 121.643 0.735 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -126.47 165.7 18.62 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 122.211 1.005 . . . . 0.0 109.736 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.4 t -78.89 145.73 33.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.139 0.971 . . . . 0.0 112.891 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -141.01 75.87 1.52 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 169.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.42 -171.82 2.75 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.567 0.699 . . . . 0.0 110.879 -175.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.8 mm -73.32 -64.25 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.586 -0.696 . . . . 0.0 111.01 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.54 -58.91 3.7 Favored Glycine 0 N--CA 1.469 0.869 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.471 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -39.44 155.61 0.15 Allowed Pre-proline 0 N--CA 1.476 0.859 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.35 147.15 12.52 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.274 1.982 . . . . 0.0 114.928 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -67.19 162.36 22.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.683 0.754 . . . . 0.0 111.476 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.9 tp -55.24 -46.48 76.01 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -169.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -102.02 42.38 1.14 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.534 -175.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.7 p -106.8 158.56 16.9 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.386 -0.821 . . . . 0.0 110.124 175.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -63.64 -39.91 95.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.435 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.47 69.95 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.0 -39.57 94.41 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.2 -39.2 74.91 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.505 -0.747 . . . . 0.0 112.544 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.26 -50.53 60.12 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.58 -0.7 . . . . 0.0 112.633 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -73.18 -39.24 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.6 p -71.42 -31.86 67.72 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -66.12 -32.43 73.88 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.538 -0.726 . . . . 0.0 112.574 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -63.08 -45.73 90.72 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.596 -0.69 . . . . 0.0 111.776 174.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.9 m -69.93 -35.53 74.6 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.75 -40.43 97.24 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.578 -0.701 . . . . 0.0 112.261 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.36 -37.99 89.46 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -76.13 126.31 30.76 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.958 0.885 . . . . 0.0 110.521 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.24 -134.93 17.7 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.738 179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -165.49 -67.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -154.27 105.42 2.69 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.99 -114.51 0.45 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.146 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.4 -55.01 4.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.757 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -18.67 -67.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -38.69 -40.67 0.63 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 -170.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -72.56 -51.27 20.56 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.236 -0.915 . . . . 0.0 111.951 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -72.03 -25.6 61.87 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.5 t -84.75 -24.16 28.93 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 171.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.6 t -85.92 -23.74 26.86 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 170.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -84.93 -33.62 22.66 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 118.726 -1.19 . . . . 0.0 112.384 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.45 -50.88 19.38 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.967 -1.083 . . . . 0.0 111.143 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -98.7 92.41 5.57 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 167.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.468 0.464 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.926 -173.339 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.406 HD23 ' C ' ' A' ' 4' ' ' LEU . 6.4 tt . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -90.13 142.39 27.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.106 0.955 . . . . 0.0 111.148 -170.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.506 ' H ' ' HB3' ' A' ' 23' ' ' SER . 4.3 t -67.45 109.08 3.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.414 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -134.39 78.52 1.76 Allowed 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 175.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -81.49 -102.54 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.894 -176.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.587 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -118.61 107.8 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 119.673 -0.811 . . . . 0.0 108.83 169.718 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.04 -49.61 1.14 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 120.124 -1.036 . . . . 0.0 113.122 176.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 3.5 m -27.37 145.28 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 116.893 2.182 . . . . 0.0 116.893 -169.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -48.63 163.99 0.24 Allowed 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.667 2.245 . . . . 0.0 116.887 -173.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.6 m -57.08 145.49 30.68 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.862 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 14' ' ' LEU . 7.4 mp -53.02 -51.46 61.62 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -175.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -98.04 75.12 2.32 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.845 0.831 . . . . 0.0 110.192 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.7 p -148.27 165.98 29.36 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.583 0.706 . . . . 0.0 109.615 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -65.16 -35.31 80.71 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -46.13 67.43 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.406 -0.809 . . . . 0.0 111.971 177.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.429 ' HA ' HG12 ' A' ' 22' ' ' VAL . 18.0 t-20 -65.13 -29.72 70.59 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -57.63 -47.51 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.686 -0.634 . . . . 0.0 112.286 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.55 -62.57 1.39 Allowed 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.445 -0.785 . . . . 0.0 111.083 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 19' ' ' ASN . 7.9 p -53.37 -28.8 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.506 ' HB3' ' H ' ' A' ' 6' ' ' CYS . 89.6 p -86.51 -29.84 22.42 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -62.68 -25.99 68.43 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.953 -1.092 . . . . 0.0 113.15 171.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -85.86 -43.82 12.95 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.926 168.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.66 -41.77 95.86 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.974 1.261 . . . . 0.0 112.645 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 tpt180 -64.73 -26.5 68.39 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -84.42 -31.48 24.62 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.609 168.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -78.93 -166.05 0.84 Allowed 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.348 -0.845 . . . . 0.0 109.09 169.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.98 -126.42 13.66 Favored Glycine 0 N--CA 1.469 0.868 0 C-N-CA 119.877 -1.154 . . . . 0.0 112.371 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -157.92 -81.66 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.942 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -157.79 -53.89 0.07 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.37 -173.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.78 -109.29 3.03 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 120.203 -0.999 . . . . 0.0 111.651 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -93.18 30.88 1.55 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -86.72 -16.11 37.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.338 -0.852 . . . . 0.0 112.367 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -69.85 -15.03 63.03 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -33.01 -52.78 0.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -172.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 48.3 mtm105 -64.18 -61.78 2.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.678 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 21.0 t -40.97 -47.77 3.07 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.472 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 46.6 t -76.26 -36.81 58.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -71.53 -47.39 55.52 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.598 -0.689 . . . . 0.0 111.406 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -71.16 -43.96 66.48 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.794 -0.566 . . . . 0.0 111.977 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -98.72 86.13 3.47 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 N--CA 1.469 0.492 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.76 -177.71 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -90.64 77.58 6.35 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.392 0.615 . . . . 0.0 109.574 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -28.82 112.73 0.07 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 -171.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -117.99 83.73 2.05 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.893 0.854 . . . . 0.0 109.504 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.87 169.2 18.4 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.746 0.784 . . . . 0.0 111.13 175.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -71.86 105.82 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 122.11 0.957 . . . . 0.0 110.302 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.87 -80.39 0.29 Allowed Glycine 0 N--CA 1.468 0.798 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -173.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -33.41 153.66 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.868 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 -175.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -44.21 141.38 4.88 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.812 2.341 . . . . 0.0 116.592 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.6 t -86.97 177.8 7.13 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.256 -176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.0 tp -54.49 -40.37 68.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -82.06 81.65 7.93 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.463 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.5 p 168.38 138.96 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 166.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -65.33 -20.74 66.53 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -178.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.3 -33.57 73.79 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.326 -0.859 . . . . 0.0 113.039 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -70.96 -40.04 72.2 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.725 173.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.09 -35.87 74.15 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 177.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.72 66.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.624 -0.672 . . . . 0.0 112.684 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.2 p -70.91 -36.59 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 O-C-N 121.671 -0.643 . . . . 0.0 112.715 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.0 p -67.93 -37.99 82.33 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.608 -0.683 . . . . 0.0 112.618 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -59.77 -35.97 75.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -65.45 -45.59 83.18 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.705 -0.622 . . . . 0.0 112.148 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.1 m -72.47 -38.13 68.3 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.659 -0.651 . . . . 0.0 112.582 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -65.91 -26.86 67.8 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.63 -39.03 49.33 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -71.91 -57.66 4.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.743 170.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.3 74.87 1.25 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 120.171 -1.014 . . . . 0.0 112.079 173.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -102.56 148.14 25.92 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.631 0.729 . . . . 0.0 110.046 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.8 mt -126.75 86.1 2.47 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 174.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 157.78 -83.42 0.14 Allowed Glycine 0 CA--C 1.526 0.763 0 C-N-CA 119.759 -1.21 . . . . 0.0 111.621 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 28.2 t70 -142.92 129.73 20.46 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 32.7 t70 172.87 -56.89 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 169.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -32.93 -49.53 0.24 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -33.86 -58.05 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -66.52 -60.2 2.95 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.52 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -36.72 -46.31 0.59 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 m -73.54 -45.71 51.98 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -67.25 -29.9 69.65 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.09 -50.24 62.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.43 -0.794 . . . . 0.0 111.646 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -87.46 72.64 9.67 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.009 0.909 . . . . 0.0 109.028 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.469 0.502 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -175.367 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -115.05 77.15 1.04 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.126 -174.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -26.37 120.79 0.08 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.882 2.179 . . . . 0.0 116.882 -172.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -94.13 79.67 4.04 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.862 0.839 . . . . 0.0 109.494 178.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -87.44 151.44 23.05 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.651 0.739 . . . . 0.0 110.826 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.72 110.32 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.884 0.85 . . . . 0.0 109.063 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.94 -48.36 0.95 Allowed Glycine 0 CA--C 1.528 0.863 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.169 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.606 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 16.2 t -64.87 150.13 95.31 Favored Pre-proline 0 CA--C 1.542 0.641 0 O-C-N 122.213 -0.581 . . . . 0.0 111.65 -175.061 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.606 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 92.5 Cg_exo -57.99 174.43 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 121.926 1.751 . . . . 0.0 115.696 -174.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -63.12 167.26 5.12 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.986 0.898 . . . . 0.0 112.849 -174.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 74.6 mt -52.96 -53.65 46.56 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -173.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -97.61 90.49 5.03 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.847 0.832 . . . . 0.0 109.063 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -148.38 176.49 10.23 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.942 0.877 . . . . 0.0 109.956 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -68.15 -45.34 73.81 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.465 -0.772 . . . . 0.0 112.413 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.61 -62.12 1.51 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.927 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -40.57 -48.72 2.9 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.581 1.696 . . . . 0.0 115.581 -172.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.71 -45.71 77.82 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.48 71.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.707 -0.62 . . . . 0.0 112.649 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.1 m -68.5 -35.47 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -70.04 -33.54 72.1 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.735 -0.603 . . . . 0.0 112.578 176.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -65.13 -38.61 91.2 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.635 -0.666 . . . . 0.0 112.241 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.99 -44.69 97.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.921 -0.487 . . . . 0.0 112.161 174.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.0 m -72.67 -32.9 66.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.2 tpt85 -69.51 -37.54 77.21 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.68 -32.83 74.44 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -142.87 81.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.93 0.871 . . . . 0.0 109.028 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.28 36.16 0.02 OUTLIER Glycine 0 CA--C 1.529 0.96 0 C-N-CA 119.854 -1.165 . . . . 0.0 113.138 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -83.55 94.52 8.08 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.83 0.824 . . . . 0.0 109.906 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.09 -44.28 0.57 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.866 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.6 44.92 1.48 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.45 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -170.74 -46.59 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -29.81 70.85 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -59.63 -33.34 71.38 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -65.44 -54.77 23.66 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.593 -0.692 . . . . 0.0 111.419 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -71.12 -32.73 69.37 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.5 t -67.05 -44.73 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -176.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 m -66.18 -37.57 85.93 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -53.32 -52.38 59.34 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.843 0.747 . . . . 0.0 112.263 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -29.69 -54.7 0.16 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -99.51 -34.87 10.08 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.9 t . . . . . 0 N--CA 1.471 0.606 0 O-C-N 121.354 -0.841 . . . . 0.0 113.227 -175.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -104.81 156.4 18.04 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.93 0.871 . . . . 0.0 110.355 -174.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.3 t -85.46 131.82 34.32 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.38 0.609 . . . . 0.0 111.145 -176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -133.8 78.01 1.74 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.12 -160.12 0.64 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.435 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.27 100.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 169.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.08 -53.98 0.5 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.796 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.0 t -74.07 167.19 37.9 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 122.456 -0.437 . . . . 0.0 109.988 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.678 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 71.5 Cg_exo -66.12 175.23 4.98 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.402 1.401 . . . . 0.0 114.739 -169.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.0 m -67.98 142.78 55.86 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.46 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.71 -40.4 72.37 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.8 60.28 5.83 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.762 0.792 . . . . 0.0 110.728 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.9 p -156.53 143.62 18.86 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.08 -23.99 66.84 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -38.31 90.62 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 112.487 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -67.35 -39.94 85.8 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.747 -0.596 . . . . 0.0 112.025 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.81 -37.74 69.04 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.73 -43.98 87.37 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.472 -0.768 . . . . 0.0 112.693 176.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' SG ' ' A' ' 11' ' ' CYS . 97.4 t -72.89 -47.1 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.756 -0.59 . . . . 0.0 111.629 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 90.9 p -67.85 -24.66 65.29 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -83.93 -22.98 31.34 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 171.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -83.44 -32.11 26.24 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 118.335 -1.346 . . . . 0.0 112.117 168.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -66.34 -41.39 89.65 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 120.968 -1.083 . . . . 0.0 111.789 170.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.8 tpt85 -35.02 -52.53 0.56 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -35.12 -57.87 0.56 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -171.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -90.24 106.11 18.27 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -175.74 92.16 0.09 OUTLIER Glycine 0 N--CA 1.465 0.608 0 C-N-CA 119.181 -1.485 . . . . 0.0 111.57 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -86.28 -61.6 1.71 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.97 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.5 mt -125.02 -62.54 1.22 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.85 80.48 0.08 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -135.99 -53.58 0.75 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.526 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.15 -56.46 6.8 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 120.326 -0.549 . . . . 0.0 111.399 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -29.54 -53.97 0.14 Allowed 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -172.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -39.55 -55.88 1.75 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -172.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.9 -56.77 10.07 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.189 -0.605 . . . . 0.0 111.057 177.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -38.23 -51.62 1.47 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.72 -34.87 52.53 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -77.57 -28.5 51.77 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -178.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -96.81 -94.36 0.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 119.351 -0.94 . . . . 0.0 108.809 170.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -28.78 -64.21 0.1 Allowed 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 42.6 t . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.6 tp . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.772 0.796 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -120.37 106.44 11.85 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -175.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.4 m -12.79 111.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -137.81 76.42 1.58 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.75 -168.3 1.55 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.763 0.792 . . . . 0.0 111.252 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -74.93 101.5 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.768 0.794 . . . . 0.0 108.971 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.72 40.41 5.31 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.069 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 19.9 t -117.38 148.73 43.3 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.613 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 84.2 Cg_exo -55.52 170.93 0.73 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.053 1.835 . . . . 0.0 114.732 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -65.71 161.72 20.09 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.523 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 tp -57.33 -59.21 5.47 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -89.62 79.92 6.74 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.386 1.089 . . . . 0.0 110.636 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.7 p -151.96 154.77 36.72 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -60.0 -39.59 86.29 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -41.43 89.92 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -66.15 -48.68 69.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.64 -33.08 72.27 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.273 -0.892 . . . . 0.0 113.148 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -50.31 64.85 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.419 -0.801 . . . . 0.0 112.291 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -74.08 -33.88 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.0 m -69.56 -39.82 77.16 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -65.96 -29.88 70.35 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.57 -47.21 82.46 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.649 -0.657 . . . . 0.0 111.974 176.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.41 -59.96 2.65 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.991 174.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -35.21 -49.23 0.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -58.66 -55.72 31.43 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -170.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -90.04 90.26 8.06 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.174 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 142.67 -35.06 1.75 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.512 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -14.72 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 -169.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.4 mt -143.09 -70.3 0.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.57 -81.01 0.08 OUTLIER Glycine 0 N--CA 1.467 0.722 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -177.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -87.01 83.22 7.54 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -158.15 -29.14 0.08 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.809 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -99.67 52.71 0.93 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.517 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -80.1 -49.54 11.6 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.023 172.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -75.71 -39.32 57.56 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.875 -0.516 . . . . 0.0 112.347 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.2 t -61.96 -43.54 98.63 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.532 -0.73 . . . . 0.0 112.914 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.4 m -68.23 -48.44 65.12 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 120.19 -0.604 . . . . 0.0 112.338 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.15 -41.62 73.6 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.05 -24.55 63.27 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -97.72 -96.62 0.21 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 168.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.613 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.8 t . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 -170.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -79.8 120.51 24.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.557 0.694 . . . . 0.0 110.614 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.437 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 30.1 p -81.79 111.68 18.24 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.965 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -92.65 73.1 5.04 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.894 0.854 . . . . 0.0 109.513 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.54 167.02 12.53 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.853 0.835 . . . . 0.0 110.494 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.1 -38.22 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.64 2.67 73.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 120.035 -1.078 . . . . 0.0 114.925 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.558 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.5 t -94.54 155.22 39.81 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 118.649 1.224 . . . . 0.0 110.424 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.558 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 50.4 Cg_exo -67.21 176.47 4.65 Favored 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 121.542 1.494 . . . . 0.0 113.871 -173.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.7 t -72.59 158.47 35.61 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.882 0.849 . . . . 0.0 111.356 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -61.11 -42.55 98.74 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -70.21 -26.85 64.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -175.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -74.51 148.98 40.46 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.866 0.841 . . . . 0.0 111.329 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.03 -19.49 65.7 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -176.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.88 91.3 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.375 -0.828 . . . . 0.0 112.712 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -68.86 -36.91 78.7 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.658 -0.651 . . . . 0.0 112.002 174.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -62.41 -42.25 99.3 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.679 -0.638 . . . . 0.0 112.226 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.33 -46.11 71.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.405 HG11 ' SG ' ' A' ' 44' ' ' CYS . 7.4 p -68.66 -29.56 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.8 p -64.17 -29.85 70.95 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.8 tptp -66.2 -41.88 89.56 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.578 -0.701 . . . . 0.0 111.761 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -64.23 -44.88 90.49 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 112.05 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.27 -31.13 72.12 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.6 tpt180 -63.18 -41.4 99.21 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.536 -0.727 . . . . 0.0 112.516 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -64.86 -36.85 85.67 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.597 -0.689 . . . . 0.0 112.416 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -81.83 126.15 31.53 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.772 0.796 . . . . 0.0 110.444 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.22 -125.76 8.23 Favored Glycine 0 N--CA 1.467 0.74 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.327 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -163.27 -67.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.402 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.49 -52.43 0.71 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.366 -0.533 . . . . 0.0 110.873 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.49 62.42 0.43 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.909 -1.139 . . . . 0.0 111.644 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -156.9 36.13 0.3 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.654 0.74 . . . . 0.0 111.893 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -161.05 -54.36 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -34.5 -42.32 0.14 Allowed 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -62.75 -57.83 9.58 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.583 -0.447 . . . . 0.0 112.02 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -63.04 -48.12 80.09 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.303 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.3 t -37.78 -59.52 0.81 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.36 -29.69 53.48 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.45 -27.28 69.17 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.939 -1.101 . . . . 0.0 113.811 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -97.08 -53.51 3.47 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.622 169.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -77.04 -45.38 27.34 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.488 -0.758 . . . . 0.0 112.935 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.545 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.0 t . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.938 0.875 . . . . 0.0 111.163 -177.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 43.3 tp . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -87.14 179.39 6.66 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.546 1.165 . . . . 0.0 112.025 -169.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.4 t -113.74 122.97 48.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.049 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -142.94 78.02 1.59 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 122.026 0.917 . . . . 0.0 108.56 174.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -87.0 -168.35 2.21 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.596 0.712 . . . . 0.0 110.848 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.9 mt -76.5 97.03 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.82 0.819 . . . . 0.0 109.038 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.57 47.74 3.4 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.734 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.578 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.2 t -117.3 150.68 46.8 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.578 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.2 Cg_exo -60.94 175.11 1.43 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 121.708 1.605 . . . . 0.0 114.305 -177.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.7 p -72.39 150.33 43.51 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.665 0.745 . . . . 0.0 110.862 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -69.02 -12.95 62.15 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -77.25 -33.94 55.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.407 -0.808 . . . . 0.0 111.889 174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.2 p -75.84 153.91 36.5 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.022 0.915 . . . . 0.0 111.44 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -67.57 -27.43 66.92 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -47.11 86.96 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.485 -0.759 . . . . 0.0 113.018 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.435 ' ND2' ' SG ' ' A' ' 11' ' ' CYS . 13.3 t-20 -70.75 -32.53 69.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.07 -34.54 76.48 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.522 -0.736 . . . . 0.0 112.619 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -35.09 79.98 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.531 -0.731 . . . . 0.0 112.887 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.15 -49.15 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 121.748 -0.595 . . . . 0.0 111.023 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -65.29 -29.8 70.6 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -67.29 -27.92 67.58 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 178.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -86.77 -37.83 17.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 118.827 -1.149 . . . . 0.0 112.496 168.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.1 m -66.63 -61.05 2.18 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.06 -1.025 . . . . 0.0 112.125 -178.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -36.89 -45.72 0.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.8 -29.55 64.97 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -176.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -64.57 -53.99 39.2 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.531 -0.731 . . . . 0.0 111.186 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.57 97.6 1.4 Allowed Glycine 0 N--CA 1.467 0.726 0 C-N-CA 119.966 -1.111 . . . . 0.0 112.094 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -145.16 101.02 3.56 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.73 157.27 18.57 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.908 0.861 . . . . 0.0 110.201 -175.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.71 -74.81 1.31 Allowed Glycine 0 N--CA 1.468 0.806 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -90.02 103.86 16.48 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -65.02 114.76 4.8 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -22.05 81.93 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 -169.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -88.17 -12.2 44.62 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -170.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.01 -62.23 1.62 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 118.323 -1.351 . . . . 0.0 108.188 167.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.7 t -43.4 -42.01 4.47 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 48.8 t -64.63 -51.35 63.11 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -68.98 -58.18 4.46 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.581 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -31.69 -67.92 0.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -91.51 52.73 2.12 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.277 0.561 . . . . 0.0 111.579 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.457 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.3 t . . . . . 0 N--CA 1.469 0.52 0 O-C-N 121.28 -0.888 . . . . 0.0 110.241 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.9 tt . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -98.4 172.17 7.71 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.512 0.673 . . . . 0.0 109.726 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 4.3 t -115.04 114.61 25.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.161 169.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -100.59 75.63 1.76 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.68 0.752 . . . . 0.0 110.44 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -107.21 153.8 22.16 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.575 0.702 . . . . 0.0 109.509 172.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.2 tp -68.08 -39.95 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.63 31.69 6.0 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.499 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.716 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 2.2 t -117.61 152.21 49.38 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.716 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 49.9 Cg_endo -71.19 -175.48 1.52 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.592 1.528 . . . . 0.0 112.882 -174.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -58.83 149.03 27.83 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.767 0.794 . . . . 0.0 112.563 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.5 mt -59.32 -47.02 86.97 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.643 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -85.04 96.06 9.29 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.393 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 p 169.82 162.32 0.06 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 166.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -61.68 -32.85 73.06 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -172.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.13 81.77 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.546 -0.722 . . . . 0.0 112.565 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -67.78 -40.22 83.99 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.654 -0.654 . . . . 0.0 112.442 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.23 -38.97 88.55 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.92 94.56 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.1 t -68.97 -45.42 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 O-C-N 121.771 -0.581 . . . . 0.0 111.377 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.3 p -63.02 -41.59 99.59 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -73.75 -30.93 63.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.57 -51.11 46.23 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.742 -0.599 . . . . 0.0 111.734 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.1 t -76.73 -28.62 55.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.718 -0.793 . . . . 0.0 113.021 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.52 -41.13 84.78 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.621 -0.674 . . . . 0.0 112.271 170.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -63.11 -36.28 83.07 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.74 -0.6 . . . . 0.0 112.523 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -69.87 -54.61 12.67 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.791 -0.568 . . . . 0.0 111.312 176.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 31' ' ' LYS . . . -94.81 -109.36 2.24 Favored Glycine 0 N--CA 1.468 0.807 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 57.6 tptt 169.52 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 167.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.5 mt -124.12 127.4 47.74 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.11 -147.91 14.08 Favored Glycine 0 CA--C 1.526 0.753 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.607 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.7 -35.38 65.15 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.229 -0.571 . . . . 0.0 112.513 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -18.37 -56.94 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.534 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 82.1 m-85 -58.86 -25.48 63.33 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -169.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -66.85 -57.58 6.72 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.121 -0.987 . . . . 0.0 111.4 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -68.99 -60.02 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.225 175.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.9 t -48.6 -29.38 4.23 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -172.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.8 m -87.08 -45.74 10.43 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 119.029 -1.069 . . . . 0.0 112.683 170.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.37 -41.31 51.66 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -178.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.44 -56.3 4.65 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.63 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -91.78 67.82 5.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.392 -0.818 . . . . 0.0 111.649 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 46.1 t . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 122.001 0.905 . . . . 0.0 109.968 175.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tt . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -80.57 94.2 6.23 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.772 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.2 t -25.32 120.33 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 117.09 2.255 . . . . 0.0 117.09 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -88.48 79.35 7.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.921 0.867 . . . . 0.0 109.749 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.11 162.09 13.69 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 122.034 0.921 . . . . 0.0 111.038 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -76.2 -66.85 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.093 -176.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.84 60.56 0.46 Allowed Glycine 0 N--CA 1.469 0.882 0 C-N-CA 120.151 -1.023 . . . . 0.0 111.872 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.656 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 13.9 t -117.46 154.77 50.61 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.656 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.9 Cg_exo -58.86 -176.16 0.09 OUTLIER 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.969 1.779 . . . . 0.0 115.464 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.2 m -57.77 144.63 37.68 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.658 0.742 . . . . 0.0 111.636 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.04 -56.5 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.408 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -91.36 68.83 5.91 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.301 1.048 . . . . 0.0 110.71 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.6 p -139.59 160.72 39.21 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.521 0.677 . . . . 0.0 109.254 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.31 -31.42 71.26 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.25 -54.63 9.02 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.58 -0.7 . . . . 0.0 112.004 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.95 -29.86 68.18 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -61.86 -39.46 91.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.414 -0.804 . . . . 0.0 112.216 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.19 -36.0 81.94 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 173.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.4 t -63.01 -48.68 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.821 -0.549 . . . . 0.0 111.132 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.8 m -64.79 -29.06 70.02 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 177.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -61.84 -54.2 45.43 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.7 -0.625 . . . . 0.0 112.112 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -73.5 -63.88 1.1 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.924 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.5 m -38.84 -43.08 0.9 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 116.925 2.194 . . . . 0.0 116.925 -174.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -48.1 -29.01 3.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -57.16 -31.89 65.85 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -177.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -132.88 121.38 22.8 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.603 -0.686 . . . . 0.0 109.591 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.24 22.09 2.18 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 120.626 -0.797 . . . . 0.0 114.612 175.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -17.72 -72.35 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -172.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.12 165.34 28.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.865 0.84 . . . . 0.0 110.62 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.44 -80.04 1.29 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 120.182 -1.009 . . . . 0.0 110.674 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.11 86.63 4.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.81 118.3 10.13 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -29.17 84.37 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -94.76 -15.05 24.14 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.681 -1.145 . . . . 0.0 114.073 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -87.23 -33.4 19.32 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 118.833 -1.147 . . . . 0.0 112.465 169.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.82 -47.25 85.45 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.377 -0.827 . . . . 0.0 112.606 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.8 m -77.45 -43.6 31.84 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -177.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -68.12 -39.77 82.66 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.586 -0.696 . . . . 0.0 112.774 -177.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -71.77 -45.83 60.34 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.662 -0.649 . . . . 0.0 112.352 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -79.47 -77.51 0.18 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.434 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.527 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 49.4 t . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -170.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.2 tp . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -78.66 156.64 28.91 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.07 0.938 . . . . 0.0 110.804 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.442 ' SG ' HG12 ' A' ' 22' ' ' VAL . 4.7 m -67.79 139.64 56.62 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.018 0.913 . . . . 0.0 111.77 178.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -149.4 77.97 1.36 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 173.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.14 -179.35 5.06 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.8 0.81 . . . . 0.0 110.908 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.2 tt -65.06 -38.05 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.38 46.96 1.04 Allowed Glycine 0 CA--C 1.529 0.946 0 C-N-CA 120.239 -0.981 . . . . 0.0 112.003 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.536 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 48.5 t -117.27 145.55 36.22 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 169.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.536 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 91.3 Cg_exo -50.19 150.5 10.56 Favored 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.264 1.976 . . . . 0.0 114.815 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.7 t -78.4 -178.5 5.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.896 0.855 . . . . 0.0 111.859 -173.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.8 -42.67 89.62 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -85.76 70.21 10.67 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.887 0.851 . . . . 0.0 110.216 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -159.6 141.11 12.94 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.7 -34.62 77.53 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.74 -38.54 89.4 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.11 -29.13 68.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.95 -38.77 89.74 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.246 -0.909 . . . . 0.0 111.887 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.77 72.63 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.442 HG12 ' SG ' ' A' ' 6' ' ' CYS . 65.0 t -69.69 -47.08 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.603 -0.686 . . . . 0.0 110.985 175.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.7 t -63.45 -34.07 76.94 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.281 -0.568 . . . . 0.0 112.422 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.92 -36.64 70.43 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.007 -1.058 . . . . 0.0 112.377 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -76.68 -55.42 5.52 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.8 -0.562 . . . . 0.0 111.756 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.2 m -77.82 -52.21 9.27 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -60.41 -26.68 66.88 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -49.0 -29.92 5.43 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -63.88 -60.24 3.52 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.383 -0.823 . . . . 0.0 111.083 173.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.76 92.18 2.23 Favored Glycine 0 N--CA 1.468 0.81 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.996 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -157.41 125.09 5.33 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.611 ' H ' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -81.77 166.74 19.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.978 0.894 . . . . 0.0 112.28 -175.904 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.77 -113.47 4.73 Favored Glycine 0 N--CA 1.466 0.699 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -142.57 47.6 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.71 0.766 . . . . 0.0 110.707 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -93.19 4.7 53.54 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -99.98 -8.44 23.9 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.349 -0.941 . . . . 0.0 113.165 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -35.97 -55.06 0.76 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.73 -38.33 70.48 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -63.61 -38.87 92.76 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.589 -0.694 . . . . 0.0 112.796 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -64.48 -47.42 79.02 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.37 -30.55 66.28 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.44 -62.04 1.7 Allowed 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.468 -0.77 . . . . 0.0 110.344 177.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 44' ' ' CYS . 40.6 mt-30 -85.58 97.27 9.98 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.309 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.506 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.2 t . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 169.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.9 tp . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 122.276 1.036 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -105.21 95.09 5.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.257 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -8.71 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -125.59 76.45 1.57 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.861 -172.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.94 -172.99 2.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.774 169.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.92 102.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 122.192 0.996 . . . . 0.0 109.85 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.39 -82.98 0.25 Allowed Glycine 0 N--CA 1.467 0.748 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.89 145.21 0.07 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -174.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.552 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 74.8 Cg_exo -58.18 162.96 10.7 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 121.927 1.751 . . . . 0.0 114.784 -174.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.5 t -67.02 165.52 15.53 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.636 0.731 . . . . 0.0 111.526 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.08 -54.64 44.7 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.867 -0.52 . . . . 0.0 112.323 -174.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -87.83 79.47 8.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.911 0.862 . . . . 0.0 110.409 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.1 p -153.28 149.88 28.37 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.38 -40.2 89.98 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.48 77.95 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -64.28 -33.64 76.29 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.9 -41.72 96.64 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 111.908 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.93 92.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 175.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.436 HG21 ' SG ' ' A' ' 44' ' ' CYS . 67.5 t -66.41 -52.24 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 O-C-N 121.753 -0.592 . . . . 0.0 111.431 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.8 t -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -55.21 -42.12 72.92 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.148 -0.97 . . . . 0.0 112.528 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -76.19 -54.06 7.36 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.807 -0.558 . . . . 0.0 112.137 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.87 -38.42 45.98 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -173.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -67.93 -27.92 67.04 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -86.69 -61.16 1.8 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 118.884 -1.127 . . . . 0.0 111.443 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -92.2 118.79 31.2 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 0.0 109.937 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.14 36.8 5.6 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.359 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -92.91 70.69 4.68 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.757 -0.849 . . . . 0.0 109.311 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.8 mt -138.39 44.7 2.1 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.134 -176.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 80.44 -84.49 1.37 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.146 -1.026 . . . . 0.0 112.838 174.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.65 87.96 7.32 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 122.202 1.001 . . . . 0.0 109.867 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -166.32 -38.09 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.04 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.536 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 97.6 m-85 -72.52 -26.83 61.91 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -65.64 -49.55 68.28 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.167 -0.958 . . . . 0.0 111.356 177.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -68.19 -32.44 72.68 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.7 t -69.45 -47.1 65.1 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.386 -0.821 . . . . 0.0 112.585 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.536 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 5.6 m -71.69 -41.09 69.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.425 -0.797 . . . . 0.0 112.254 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -78.91 -29.5 44.25 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -99.04 -60.49 1.52 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.291 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -69.97 -71.04 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.498 -172.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.552 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 50.3 t . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 -172.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 tt . . . . . 0 N--CA 1.468 0.445 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -135.52 109.09 7.94 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.9 m -13.06 118.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -146.39 83.73 1.62 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 170.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.28 -153.76 0.16 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.519 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.7 mm -71.83 -58.88 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.275 -0.89 . . . . 0.0 110.782 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -76.86 -55.9 4.31 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.836 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.605 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.68 139.28 0.16 Allowed Pre-proline 0 N--CA 1.477 0.881 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -170.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.618 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 39.6 Cg_endo -67.43 176.95 4.31 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 121.738 1.625 . . . . 0.0 113.431 -173.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.3 p -74.12 153.29 39.64 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.656 0.741 . . . . 0.0 111.265 -175.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.763 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -71.14 -3.64 21.06 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.214 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -97.31 -19.08 18.77 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.446 -0.784 . . . . 0.0 112.915 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -75.84 146.69 39.67 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.205 -0.934 . . . . 0.0 110.932 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.02 -41.46 71.38 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -172.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.01 76.91 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -71.25 -35.33 71.37 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.75 -30.44 70.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.246 -0.909 . . . . 0.0 112.893 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.09 33.1 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.26 -0.9 . . . . 0.0 112.051 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.0 p -67.64 -39.67 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.6 p -75.88 -35.55 59.83 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -176.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -66.48 -29.79 69.98 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.81 -52.29 66.08 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.469 -0.769 . . . . 0.0 112.223 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.9 m -76.94 -31.75 56.84 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -66.36 -43.67 85.35 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.994 -1.066 . . . . 0.0 112.257 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -67.62 -43.88 79.36 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.66 -0.65 . . . . 0.0 112.149 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -120.95 100.15 6.91 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -53.97 0.31 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 119.89 -1.148 . . . . 0.0 111.309 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -15.04 100.17 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.6 tp -160.86 -62.27 0.06 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.918 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.37 -68.46 0.29 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.127 -1.189 . . . . 0.0 110.127 -174.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 19.4 m-20 -85.49 85.12 7.45 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 38.8 t70 172.86 11.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.2 168.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.481 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 95.9 m-85 -101.3 -29.79 11.86 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.581 -1.324 . . . . 0.0 112.295 169.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -70.23 -50.04 43.93 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.149 -0.969 . . . . 0.0 110.918 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.492 ' HE ' ' HA ' ' A' ' 35' ' ' ASP . 38.3 ptt180 -67.68 -39.65 84.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.4 t -65.46 -43.89 88.91 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.485 -0.76 . . . . 0.0 113.051 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.481 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 73.5 m -63.69 -62.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.853 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -42.33 -62.65 0.91 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -174.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -36.95 -62.15 0.51 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -173.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -91.74 -12.15 34.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.618 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.9 t . . . . . 0 N--CA 1.468 0.448 0 O-C-N 121.136 -0.977 . . . . 0.0 110.522 -174.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.8 tp . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -94.37 161.43 14.24 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.858 0.837 . . . . 0.0 110.215 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 t -82.5 85.29 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -124.8 77.26 1.59 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.014 -0.675 . . . . 0.0 110.199 -171.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.421 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . . . -92.08 -106.16 0.11 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.629 -0.829 . . . . 0.0 109.451 173.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.5 mm -90.41 -69.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -171.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.78 -50.98 4.2 Favored Glycine 0 N--CA 1.47 0.923 0 C-N-CA 120.126 -1.035 . . . . 0.0 113.71 -172.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 19' ' ' ASN . 7.3 t -20.85 133.87 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -170.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.728 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 71.2 Cg_exo -54.43 170.98 0.46 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.329 2.019 . . . . 0.0 114.941 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -61.68 164.81 5.67 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 122.123 0.963 . . . . 0.0 112.698 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -171.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -99.61 52.05 0.93 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.781 -174.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.2 p -108.21 166.36 10.8 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.778 0.799 . . . . 0.0 110.178 176.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.32 -44.62 78.71 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.423 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.17 81.18 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 11' ' ' CYS . 13.0 t-20 -65.46 -29.8 70.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.7 -41.46 90.8 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.407 -0.808 . . . . 0.0 113.124 -178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.03 69.74 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.562 -0.711 . . . . 0.0 112.817 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HB2' ' A' ' 44' ' ' CYS . 14.8 p -70.01 -39.79 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.5 p -66.36 -21.95 66.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -82.48 -23.34 34.76 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 171.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -85.64 -49.73 7.77 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.47 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.94 -28.34 64.41 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -67.44 -26.05 66.21 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.954 -1.091 . . . . 0.0 113.279 171.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -84.08 -44.22 14.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 118.852 -1.139 . . . . 0.0 111.117 168.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -85.21 71.76 10.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.222 -0.924 . . . . 0.0 109.189 171.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -132.64 125.1 4.04 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -83.98 -101.48 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.022 -0.671 . . . . 0.0 109.432 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.7 mt -140.4 76.19 1.54 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.77 -44.73 3.39 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 119.923 -1.132 . . . . 0.0 113.843 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -68.18 -69.03 0.35 Allowed 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.985 -0.715 . . . . 0.0 111.914 -174.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -19.47 -67.1 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 -173.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -35.32 -47.37 0.41 Allowed 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -174.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -35.39 -53.65 0.65 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -175.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -66.4 -61.21 2.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.444 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.8 t -37.07 -49.13 0.84 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 3.1 m -72.49 -35.63 68.21 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -175.385 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -72.35 -48.55 41.03 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.294 -0.879 . . . . 0.0 111.323 175.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -81.44 -96.27 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -34.14 -53.2 0.48 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -173.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.728 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 43.5 t . . . . . 0 N--CA 1.468 0.454 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.5 tp . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 117.734 2.494 . . . . 0.0 117.734 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -99.36 139.24 35.31 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.962 175.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.8 t -83.92 93.72 8.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.712 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -97.76 78.51 2.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.833 0.825 . . . . 0.0 109.234 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 155.54 32.28 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.636 0.732 . . . . 0.0 110.762 177.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.59 110.63 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 121.871 0.843 . . . . 0.0 109.9 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.3 -42.39 1.82 Allowed Glycine 0 CA--C 1.53 1.013 0 C-N-CA 120.237 -0.982 . . . . 0.0 112.001 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.2 m -80.74 169.47 19.39 Favored Pre-proline 0 CA--C 1.542 0.645 0 O-C-N 122.096 -0.649 . . . . 0.0 110.71 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -58.63 152.84 53.03 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 121.877 1.718 . . . . 0.0 115.44 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -76.68 164.43 25.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.556 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.1 tp -50.29 -50.4 50.56 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -173.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -90.84 36.75 0.91 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.737 -0.785 . . . . 0.0 112.834 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.6 p -109.98 151.25 27.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.954 0.883 . . . . 0.0 110.451 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.33 -33.54 75.74 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.64 -55.68 24.75 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.718 -0.613 . . . . 0.0 111.215 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 22' ' ' VAL . 20.5 t-20 -37.92 -40.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -177.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.9 mp -54.13 -38.41 65.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.46 -43.42 66.68 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 19' ' ' ASN . 8.1 p -65.23 -22.75 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 176.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -82.42 -55.19 4.65 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 118.224 -1.39 . . . . 0.0 109.493 167.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -36.14 -54.98 0.79 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -175.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.93 -46.42 24.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -177.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.4 m -63.07 -50.24 71.37 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.548 -0.72 . . . . 0.0 112.385 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -55.85 -32.68 63.84 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.8 -29.31 68.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 175.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -76.04 95.33 3.59 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.67 0.748 . . . . 0.0 110.043 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.41 -130.61 9.95 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.468 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -163.76 -56.19 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.331 -0.548 . . . . 0.0 109.964 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.2 tp -145.38 111.75 5.74 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.75 -167.08 37.23 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.719 -1.229 . . . . 0.0 111.846 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -89.49 15.37 9.43 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.15 -27.93 57.18 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.232 -0.918 . . . . 0.0 112.614 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.451 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 22.6 m-85 -71.6 -24.74 61.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -172.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.34 -49.3 77.51 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.416 -0.803 . . . . 0.0 112.072 -177.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -63.45 -39.2 93.85 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.675 -0.641 . . . . 0.0 112.455 176.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.0 t -61.47 -44.95 96.18 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 4.4 m -73.69 -29.21 62.15 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.95 -26.85 66.32 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 172.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -92.39 -98.91 0.13 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 167.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -36.57 112.85 0.2 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 52.7 t . . . . . 0 N--CA 1.47 0.567 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.268 -169.681 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 44.2 tp . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -84.18 85.86 7.3 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.809 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -26.14 121.18 0.07 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.578 2.066 . . . . 0.0 116.578 -175.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -89.36 78.97 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.749 0.785 . . . . 0.0 109.852 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.83 154.51 35.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.69 0.757 . . . . 0.0 110.144 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.4 mm -81.03 99.86 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-O 121.667 0.746 . . . . 0.0 109.937 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.81 -82.65 0.15 Allowed Glycine 0 N--CA 1.467 0.726 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.8 t -35.19 150.75 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -171.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 87.9 Cg_exo -55.87 -173.29 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.4 2.067 . . . . 0.0 116.541 -174.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.7 m -50.91 146.33 6.17 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.436 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.6 tp -55.8 -51.91 65.83 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -100.08 81.9 2.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.694 0.759 . . . . 0.0 109.282 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -143.67 171.27 14.42 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.842 0.829 . . . . 0.0 110.341 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -67.58 -43.0 81.65 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.761 -0.587 . . . . 0.0 112.36 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.57 -45.21 80.05 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.733 -0.604 . . . . 0.0 112.462 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.7 -31.53 72.59 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.3 tp -64.32 -41.7 96.68 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.297 -0.877 . . . . 0.0 112.297 175.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.23 76.46 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.636 -0.665 . . . . 0.0 112.785 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.542 HG11 ' SG ' ' A' ' 11' ' ' CYS . 14.6 p -62.72 -41.43 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.691 -0.631 . . . . 0.0 112.396 178.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.9 p -66.43 -29.93 70.18 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -67.06 -28.61 68.34 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -86.71 -63.21 1.35 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 118.293 -1.363 . . . . 0.0 109.76 167.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.433 ' SG ' HG22 ' A' ' 22' ' ' VAL . 73.1 m -37.25 -47.84 0.83 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.378 1.992 . . . . 0.0 116.378 -174.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -51.76 -29.16 17.64 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -57.31 -29.31 63.82 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -71.34 176.19 4.8 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.96 0.886 . . . . 0.0 110.662 175.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.4 120.02 17.78 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 120.392 -0.909 . . . . 0.0 113.298 -174.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 ttmt -84.52 95.69 8.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.698 0.761 . . . . 0.0 110.084 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -113.1 -45.27 3.18 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.95 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.36 -89.12 0.08 OUTLIER Glycine 0 CA--C 1.523 0.575 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -101.21 44.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.676 0.751 . . . . 0.0 110.376 172.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -96.39 3.63 52.75 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.606 -0.684 . . . . 0.0 112.54 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -99.68 -1.65 37.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.695 169.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -34.05 -54.3 0.48 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -68.29 -57.46 5.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.02 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 23.0 t -40.02 -38.46 0.72 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 117.571 2.434 . . . . 0.0 117.571 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.3 m -90.18 -24.63 20.97 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 172.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -86.22 -25.71 25.46 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -96.58 -46.89 6.15 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.149 -0.969 . . . . 0.0 112.139 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -99.18 71.03 1.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 118.993 -1.083 . . . . 0.0 110.719 170.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.617 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.7 t . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 166.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 121.584 0.707 . . . . 0.0 109.276 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.15 147.87 26.4 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.3 t -85.22 107.56 17.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.058 -173.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -99.92 80.65 2.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.696 0.76 . . . . 0.0 109.447 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.59 -149.28 0.25 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.603 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.51 111.6 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 169.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.84 38.0 6.65 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.414 -0.898 . . . . 0.0 113.337 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.648 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.6 t -117.93 153.22 50.96 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.685 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.648 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -56.49 175.75 0.25 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.093 1.862 . . . . 0.0 114.852 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 75.3 p -59.93 149.21 32.43 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.592 0.71 . . . . 0.0 111.461 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.84 -47.03 77.98 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -171.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.16 0.1 46.82 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -177.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -73.12 161.12 30.99 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.902 -1.124 . . . . 0.0 111.626 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -67.63 -33.16 74.42 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.08 -43.57 86.96 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.591 -0.693 . . . . 0.0 112.53 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -66.96 -36.55 82.45 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.644 -0.66 . . . . 0.0 112.313 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.72 -42.63 99.75 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.67 -0.644 . . . . 0.0 111.701 175.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.32 -43.18 99.41 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.79 -37.49 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.55 -0.719 . . . . 0.0 112.469 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -64.01 -35.11 79.65 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.531 -0.731 . . . . 0.0 112.096 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -57.36 -40.56 78.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -68.39 -63.95 0.96 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.528 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.0 m -41.97 -43.48 3.15 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.1 -28.77 69.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -178.072 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -57.97 -26.24 62.06 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.56 -49.75 76.54 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.72 -0.613 . . . . 0.0 112.054 176.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 133.96 83.79 0.21 Allowed Glycine 0 N--CA 1.468 0.82 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 178.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -14.2 100.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -168.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -89.56 -53.6 4.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.628 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.71 -73.76 0.41 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 -171.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -86.64 73.41 10.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.42 1.105 . . . . 0.0 109.895 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -157.52 -41.59 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.168 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -65.81 -31.75 72.88 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.76 -52.43 56.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.564 -0.71 . . . . 0.0 111.48 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -68.55 -38.36 80.72 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.699 -0.626 . . . . 0.0 112.606 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -55.79 -52.98 62.09 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.8 m -77.86 -33.62 52.08 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -62.06 -28.58 69.71 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -95.87 -35.34 11.51 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 119.102 -1.039 . . . . 0.0 112.538 171.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.9 -78.6 0.1 Allowed 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.205 -0.935 . . . . 0.0 110.126 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.587 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 33.9 t . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 117.338 2.347 . . . . 0.0 117.338 -173.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -97.0 131.4 43.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.825 0.822 . . . . 0.0 110.065 -170.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 23' ' ' SER . 28.8 p -85.82 100.17 11.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.843 -172.43 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -98.63 85.78 3.42 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 172.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.96 -148.21 0.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.81 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.8 mt -116.67 100.96 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 169.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 140.99 -54.13 0.64 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.217 -0.992 . . . . 0.0 110.686 -173.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.593 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.0 t -77.76 161.52 71.28 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.297 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.593 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 52.1 Cg_exo -71.16 -174.67 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 CA-C-N 120.816 1.327 . . . . 0.0 114.352 -169.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -73.44 146.77 44.76 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.512 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -18.97 64.59 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -175.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -72.61 -31.17 64.97 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.47 -0.769 . . . . 0.0 112.357 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.0 p -73.75 149.28 41.88 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.739 0.781 . . . . 0.0 111.29 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -67.52 -24.26 65.54 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.28 -43.72 98.18 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.55 -0.718 . . . . 0.0 112.717 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -73.79 -29.4 62.15 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.944 -0.702 . . . . 0.0 112.301 177.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.8 -43.47 98.73 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.353 -0.842 . . . . 0.0 112.591 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.42 -42.68 82.82 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.577 HG21 ' SG ' ' A' ' 11' ' ' CYS . 30.1 m -68.76 -25.3 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.509 ' HB2' ' SG ' ' A' ' 6' ' ' CYS . 10.4 t -85.59 -26.91 25.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 118.848 -1.141 . . . . 0.0 113.19 168.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -50.42 -44.07 55.13 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.393 0.997 . . . . 0.0 113.257 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.02 -62.0 1.74 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.752 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.4 m -44.43 -34.39 2.02 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -85.35 -39.43 17.65 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 172.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -66.15 -57.97 6.46 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.997 -1.065 . . . . 0.0 110.761 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -108.6 88.44 2.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.04 -60.19 0.28 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 119.24 -1.457 . . . . 0.0 112.764 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -15.26 111.15 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -168.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -154.33 -51.89 0.09 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.146 -0.621 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.26 -72.21 0.25 Allowed Glycine 0 N--CA 1.466 0.683 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -174.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -67.74 -50.14 58.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.781 173.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -18.91 -57.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -53.03 -54.41 35.71 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -172.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -38.89 -61.49 0.73 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -72.89 -36.96 67.44 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -54.1 -51.43 64.22 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.0 m -77.19 -52.59 8.98 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.409 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -54.7 -37.26 65.62 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -69.54 -56.73 6.53 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.526 -0.734 . . . . 0.0 110.982 175.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.57 56.22 3.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.761 -0.587 . . . . 0.0 111.649 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.472 0.653 0 O-C-N 121.49 -0.756 . . . . 0.0 109.761 179.148 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -94.29 142.13 27.76 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.861 0.838 . . . . 0.0 109.01 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 11.9 t -76.63 135.1 39.15 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.934 -171.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -89.36 83.28 6.41 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.22 143.26 33.19 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.697 0.761 . . . . 0.0 110.013 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.5 pt -73.85 -24.73 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.49 60.49 0.54 Allowed Glycine 0 N--CA 1.469 0.86 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.926 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.718 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 15.1 t -116.93 156.0 48.63 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 169.121 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.718 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 85.0 Cg_exo -59.9 -179.71 0.23 Allowed 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.801 1.667 . . . . 0.0 115.535 -174.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -62.58 163.78 8.5 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.79 0.805 . . . . 0.0 112.612 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.5 tp -57.68 -50.72 72.25 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -171.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -94.35 50.29 1.36 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.999 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.9 p -112.85 169.53 8.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.833 0.825 . . . . 0.0 110.296 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.03 -40.97 78.29 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.135 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.5 -44.05 75.56 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -64.52 -33.08 75.06 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.52 -41.21 89.17 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.507 -0.745 . . . . 0.0 112.159 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.26 -62.21 1.5 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.58 -0.7 . . . . 0.0 111.317 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.1 p -42.19 -46.21 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -174.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -71.25 -40.4 71.02 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -63.25 -38.04 89.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.79 -63.92 0.96 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.421 -0.799 . . . . 0.0 109.769 176.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -44.3 -40.07 4.99 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -56.89 -46.72 81.71 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -67.57 -57.92 5.61 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.772 -0.58 . . . . 0.0 111.143 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -96.5 82.27 3.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 141.55 40.23 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 120.22 -0.991 . . . . 0.0 112.934 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -87.45 81.79 7.71 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.998 -0.707 . . . . 0.0 109.163 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -138.24 -58.62 0.64 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.722 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.04 -68.86 0.5 Allowed Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -172.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -89.8 78.6 6.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 122.455 1.121 . . . . 0.0 108.867 175.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -161.14 -56.98 0.05 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.466 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 90.8 m-85 -38.78 -40.43 0.62 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -174.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -57.96 -47.56 82.57 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -67.78 -41.32 83.44 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.65 -0.656 . . . . 0.0 112.116 176.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -59.39 -45.64 90.9 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 22.6 m -77.22 -40.72 44.02 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -175.066 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -68.2 -29.82 68.77 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -68.97 -48.7 62.52 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.392 -0.817 . . . . 0.0 111.84 178.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.62 -57.16 3.45 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.805 -0.559 . . . . 0.0 110.967 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 42.6 t . . . . . 0 N--CA 1.468 0.437 0 CA-C-O 122.016 0.912 . . . . 0.0 111.34 -176.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -131.19 165.4 23.42 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.39 137.47 56.9 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.32 -0.862 . . . . 0.0 111.665 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -131.71 76.92 1.74 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 171.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -94.64 -176.49 3.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.922 0.868 . . . . 0.0 111.048 -176.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.9 mm -71.39 -56.68 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.765 -0.585 . . . . 0.0 111.113 -175.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.59 33.94 5.83 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 120.021 -1.085 . . . . 0.0 113.997 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.9 t -116.87 160.4 36.95 Favored Pre-proline 0 CA--C 1.543 0.682 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.1 Cg_exo -67.61 -178.32 1.51 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 CA-C-N 121.082 1.422 . . . . 0.0 114.099 -171.113 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.3 t -66.23 158.39 29.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.725 0.774 . . . . 0.0 111.594 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.57 -55.23 37.51 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.346 -173.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.41 80.44 8.13 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.927 0.87 . . . . 0.0 110.24 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.9 p -153.81 153.85 32.89 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.549 0.69 . . . . 0.0 109.396 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.42 -36.47 84.27 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -48.5 73.26 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.667 -0.645 . . . . 0.0 112.256 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -63.17 -37.23 86.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.721 -0.612 . . . . 0.0 112.605 175.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.17 -44.17 95.25 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.895 -0.503 . . . . 0.0 111.727 178.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.96 -39.15 93.82 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.653 0.982 . . . . 0.0 113.653 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.0 t -59.6 -49.56 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 O-C-N 121.64 -0.662 . . . . 0.0 111.196 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 95.0 p -66.0 -30.4 70.94 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -61.85 -28.41 69.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -88.25 -55.35 3.78 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 118.769 -1.172 . . . . 0.0 112.896 169.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.7 m -77.99 -47.07 19.36 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -171.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -57.71 -29.37 64.65 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.59 -28.01 65.18 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -77.55 93.27 4.15 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.488 -0.757 . . . . 0.0 110.05 177.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.59 -133.37 11.63 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 119.959 -1.115 . . . . 0.0 111.065 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -164.75 -56.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.094 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -78.28 152.72 32.34 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 122.013 0.911 . . . . 0.0 111.523 -171.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.1 71.9 2.31 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.188 -1.006 . . . . 0.0 113.063 -175.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -141.43 55.86 1.52 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 122.256 1.027 . . . . 0.0 108.424 170.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -174.16 -41.77 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.333 -174.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -68.35 -22.56 64.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -31.31 -51.25 0.18 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -173.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -61.49 -63.53 1.24 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.582 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 14.5 t -38.73 -49.9 1.62 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 17.0 t -68.81 -27.46 65.88 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -87.13 -61.66 1.67 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.019 166.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -28.52 -63.73 0.1 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -88.0 -50.94 6.09 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.465 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.485 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 51.4 t . . . . . 0 N--CA 1.467 0.389 0 CA-C-O 122.146 0.974 . . . . 0.0 110.841 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -127.92 102.17 22.33 Favored Pre-proline 0 N--CA 1.47 0.555 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -60.32 127.4 22.85 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 121.944 1.763 . . . . 0.0 113.2 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.3 tp -93.83 103.35 15.48 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.643 0.735 . . . . 0.0 109.791 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -126.47 165.7 18.62 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 122.211 1.005 . . . . 0.0 109.736 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.4 t -78.89 145.73 33.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.139 0.971 . . . . 0.0 112.891 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -141.01 75.87 1.52 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 169.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.42 -171.82 2.75 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.567 0.699 . . . . 0.0 110.879 -175.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.8 mm -73.32 -64.25 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.586 -0.696 . . . . 0.0 111.01 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.54 -58.91 3.7 Favored Glycine 0 N--CA 1.469 0.869 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.471 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -39.44 155.61 0.15 Allowed Pre-proline 0 N--CA 1.476 0.859 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.35 147.15 12.52 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.274 1.982 . . . . 0.0 114.928 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -67.19 162.36 22.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.683 0.754 . . . . 0.0 111.476 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.9 tp -55.24 -46.48 76.01 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -169.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -102.02 42.38 1.14 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.534 -175.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.7 p -106.8 158.56 16.9 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.386 -0.821 . . . . 0.0 110.124 175.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -63.64 -39.91 95.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.435 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.47 69.95 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.0 -39.57 94.41 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.2 -39.2 74.91 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.505 -0.747 . . . . 0.0 112.544 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.26 -50.53 60.12 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.58 -0.7 . . . . 0.0 112.633 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -73.18 -39.24 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.6 p -71.42 -31.86 67.72 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -66.12 -32.43 73.88 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.538 -0.726 . . . . 0.0 112.574 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -63.08 -45.73 90.72 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.596 -0.69 . . . . 0.0 111.776 174.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.9 m -69.93 -35.53 74.6 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.75 -40.43 97.24 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.578 -0.701 . . . . 0.0 112.261 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.36 -37.99 89.46 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -76.13 126.31 30.76 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.958 0.885 . . . . 0.0 110.521 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.24 -134.93 17.7 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.738 179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -165.49 -67.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -154.27 105.42 2.69 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.99 -114.51 0.45 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.146 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.4 -55.01 4.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.757 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -18.67 -67.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -38.69 -40.67 0.63 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 -170.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -72.56 -51.27 20.56 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.236 -0.915 . . . . 0.0 111.951 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -72.03 -25.6 61.87 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.5 t -84.75 -24.16 28.93 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 171.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.6 t -85.92 -23.74 26.86 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 170.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -84.93 -33.62 22.66 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 118.726 -1.19 . . . . 0.0 112.384 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.45 -50.88 19.38 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.967 -1.083 . . . . 0.0 111.143 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -98.7 92.41 5.57 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 167.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t -102.12 -64.27 1.08 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.926 -173.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.3 -89.65 0.08 OUTLIER Glycine 0 CA--C 1.524 0.642 0 C-N-CA 119.838 -1.172 . . . . 0.0 110.434 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.0 t -88.91 105.5 17.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 109.699 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.4 t -88.1 140.88 29.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.741 0.781 . . . . 0.0 110.437 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.5 t -86.01 137.72 35.25 Favored Pre-proline 0 N--CA 1.47 0.542 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.084 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.57 112.72 3.21 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.718 1.612 . . . . 0.0 110.906 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.41 121.16 4.16 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 70.0 m -90.46 109.78 20.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.426 0.631 . . . . 0.0 109.721 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.176 -179.88 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -132.09 93.6 26.17 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -177.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.412 ' O ' ' C ' ' A' ' 4' ' ' LEU . 93.5 Cg_endo -79.78 -105.18 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 121.602 1.535 . . . . 0.0 109.943 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.412 ' C ' ' O ' ' A' ' 3' ' ' PRO . 6.4 tt -16.63 106.46 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -169.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -90.13 142.39 27.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.106 0.955 . . . . 0.0 111.148 -170.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.506 ' H ' ' HB3' ' A' ' 23' ' ' SER . 4.3 t -67.45 109.08 3.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.414 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -134.39 78.52 1.76 Allowed 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 175.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -81.49 -102.54 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.894 -176.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.587 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -118.61 107.8 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 119.673 -0.811 . . . . 0.0 108.83 169.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.04 -49.61 1.14 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 120.124 -1.036 . . . . 0.0 113.122 176.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 3.5 m -27.37 145.28 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 116.893 2.182 . . . . 0.0 116.893 -169.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -48.63 163.99 0.24 Allowed 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.667 2.245 . . . . 0.0 116.887 -173.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.6 m -57.08 145.49 30.68 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.862 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 14' ' ' LEU . 7.4 mp -53.02 -51.46 61.62 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -175.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -98.04 75.12 2.32 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.845 0.831 . . . . 0.0 110.192 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.7 p -148.27 165.98 29.36 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.583 0.706 . . . . 0.0 109.615 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -65.16 -35.31 80.71 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -46.13 67.43 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.406 -0.809 . . . . 0.0 111.971 177.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.429 ' HA ' HG12 ' A' ' 22' ' ' VAL . 18.0 t-20 -65.13 -29.72 70.59 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -57.63 -47.51 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.686 -0.634 . . . . 0.0 112.286 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.55 -62.57 1.39 Allowed 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.445 -0.785 . . . . 0.0 111.083 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 19' ' ' ASN . 7.9 p -53.37 -28.8 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.506 ' HB3' ' H ' ' A' ' 6' ' ' CYS . 89.6 p -86.51 -29.84 22.42 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -62.68 -25.99 68.43 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.953 -1.092 . . . . 0.0 113.15 171.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -85.86 -43.82 12.95 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.926 168.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.66 -41.77 95.86 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.974 1.261 . . . . 0.0 112.645 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 tpt180 -64.73 -26.5 68.39 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -84.42 -31.48 24.62 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.609 168.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -78.93 -166.05 0.84 Allowed 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.348 -0.845 . . . . 0.0 109.09 169.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.98 -126.42 13.66 Favored Glycine 0 N--CA 1.469 0.868 0 C-N-CA 119.877 -1.154 . . . . 0.0 112.371 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -157.92 -81.66 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.942 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -157.79 -53.89 0.07 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.37 -173.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.78 -109.29 3.03 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 120.203 -0.999 . . . . 0.0 111.651 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -93.18 30.88 1.55 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -86.72 -16.11 37.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.338 -0.852 . . . . 0.0 112.367 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -69.85 -15.03 63.03 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -33.01 -52.78 0.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -172.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 48.3 mtm105 -64.18 -61.78 2.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.678 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 21.0 t -40.97 -47.77 3.07 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.472 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 46.6 t -76.26 -36.81 58.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -71.53 -47.39 55.52 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.598 -0.689 . . . . 0.0 111.406 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -71.16 -43.96 66.48 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.794 -0.566 . . . . 0.0 111.977 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -98.72 86.13 3.47 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 53.9 t -102.5 -57.18 2.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.76 -177.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.01 -55.6 0.53 Allowed Glycine 0 N--CA 1.469 0.833 0 C-N-CA 120.418 -0.896 . . . . 0.0 111.225 -176.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.0 m -137.34 140.27 41.37 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 176.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 69.2 p -135.46 -50.26 0.73 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.614 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.2 m -15.1 101.29 0.05 OUTLIER Pre-proline 0 N--CA 1.481 1.079 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -169.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -62.24 126.08 17.79 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 121.839 1.693 . . . . 0.0 113.276 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.0 121.37 4.38 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.8 t -86.63 -60.78 1.9 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.133 -0.627 . . . . 0.0 111.053 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.373 -0.822 . . . . 0.0 111.269 -177.841 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.23 144.22 33.89 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.937 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.74 121.5 5.95 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.874 1.716 . . . . 0.0 111.258 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.0 tp -89.9 113.52 25.15 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -90.64 77.58 6.35 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.392 0.615 . . . . 0.0 109.574 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -28.82 112.73 0.07 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 -171.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -117.99 83.73 2.05 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.893 0.854 . . . . 0.0 109.504 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.87 169.2 18.4 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.746 0.784 . . . . 0.0 111.13 175.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -71.86 105.82 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 122.11 0.957 . . . . 0.0 110.302 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.87 -80.39 0.29 Allowed Glycine 0 N--CA 1.468 0.798 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -173.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -33.41 153.66 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.868 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 -175.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -44.21 141.38 4.88 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.812 2.341 . . . . 0.0 116.592 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.6 t -86.97 177.8 7.13 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.256 -176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.0 tp -54.49 -40.37 68.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -82.06 81.65 7.93 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.463 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.5 p 168.38 138.96 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 166.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -65.33 -20.74 66.53 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -178.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.3 -33.57 73.79 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.326 -0.859 . . . . 0.0 113.039 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -70.96 -40.04 72.2 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.725 173.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.09 -35.87 74.15 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 177.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.72 66.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.624 -0.672 . . . . 0.0 112.684 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.2 p -70.91 -36.59 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 O-C-N 121.671 -0.643 . . . . 0.0 112.715 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.0 p -67.93 -37.99 82.33 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.608 -0.683 . . . . 0.0 112.618 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -59.77 -35.97 75.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -65.45 -45.59 83.18 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.705 -0.622 . . . . 0.0 112.148 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.1 m -72.47 -38.13 68.3 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.659 -0.651 . . . . 0.0 112.582 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -65.91 -26.86 67.8 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.63 -39.03 49.33 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -71.91 -57.66 4.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.743 170.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.3 74.87 1.25 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 120.171 -1.014 . . . . 0.0 112.079 173.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -102.56 148.14 25.92 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.631 0.729 . . . . 0.0 110.046 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.8 mt -126.75 86.1 2.47 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 174.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 157.78 -83.42 0.14 Allowed Glycine 0 CA--C 1.526 0.763 0 C-N-CA 119.759 -1.21 . . . . 0.0 111.621 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 28.2 t70 -142.92 129.73 20.46 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 32.7 t70 172.87 -56.89 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 169.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -32.93 -49.53 0.24 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -33.86 -58.05 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -66.52 -60.2 2.95 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.52 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -36.72 -46.31 0.59 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 m -73.54 -45.71 51.98 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -67.25 -29.9 69.65 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.09 -50.24 62.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.43 -0.794 . . . . 0.0 111.646 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -87.46 72.64 9.67 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.009 0.909 . . . . 0.0 109.028 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.1 t -166.64 -66.27 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.26 -108.5 0.36 Allowed Glycine 0 N--CA 1.466 0.662 0 C-N-CA 119.823 -1.18 . . . . 0.0 110.728 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.6 m -142.07 107.29 4.98 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.3 p -86.92 132.34 33.84 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.014 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.8 t -14.91 102.34 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.032 0 N-CA-C 117.166 2.284 . . . . 0.0 117.166 -169.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -84.8 97.02 0.67 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 121.405 1.403 . . . . 0.0 110.755 -174.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -24.11 -66.42 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 -172.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -16.43 -73.06 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 117.842 2.534 . . . . 0.0 117.842 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.148 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.461 -177.644 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -114.41 104.8 54.41 Favored Pre-proline 0 CA--C 1.538 0.481 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.9 77.44 2.97 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 121.534 1.489 . . . . 0.0 111.452 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.8 tt -97.14 109.07 21.9 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -115.05 77.15 1.04 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.126 -174.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -26.37 120.79 0.08 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.882 2.179 . . . . 0.0 116.882 -172.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -94.13 79.67 4.04 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.862 0.839 . . . . 0.0 109.494 178.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -87.44 151.44 23.05 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.651 0.739 . . . . 0.0 110.826 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.72 110.32 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.884 0.85 . . . . 0.0 109.063 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.94 -48.36 0.95 Allowed Glycine 0 CA--C 1.528 0.863 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.169 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.606 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 16.2 t -64.87 150.13 95.31 Favored Pre-proline 0 CA--C 1.542 0.641 0 O-C-N 122.213 -0.581 . . . . 0.0 111.65 -175.061 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.606 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 92.5 Cg_exo -57.99 174.43 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 121.926 1.751 . . . . 0.0 115.696 -174.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -63.12 167.26 5.12 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.986 0.898 . . . . 0.0 112.849 -174.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 74.6 mt -52.96 -53.65 46.56 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -173.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -97.61 90.49 5.03 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.847 0.832 . . . . 0.0 109.063 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -148.38 176.49 10.23 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.942 0.877 . . . . 0.0 109.956 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -68.15 -45.34 73.81 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.465 -0.772 . . . . 0.0 112.413 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.61 -62.12 1.51 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.927 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -40.57 -48.72 2.9 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.581 1.696 . . . . 0.0 115.581 -172.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.71 -45.71 77.82 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.48 71.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.707 -0.62 . . . . 0.0 112.649 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.1 m -68.5 -35.47 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -70.04 -33.54 72.1 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.735 -0.603 . . . . 0.0 112.578 176.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -65.13 -38.61 91.2 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.635 -0.666 . . . . 0.0 112.241 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.99 -44.69 97.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.921 -0.487 . . . . 0.0 112.161 174.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.0 m -72.67 -32.9 66.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.2 tpt85 -69.51 -37.54 77.21 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.68 -32.83 74.44 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -142.87 81.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.93 0.871 . . . . 0.0 109.028 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.28 36.16 0.02 OUTLIER Glycine 0 CA--C 1.529 0.96 0 C-N-CA 119.854 -1.165 . . . . 0.0 113.138 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -83.55 94.52 8.08 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.83 0.824 . . . . 0.0 109.906 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.09 -44.28 0.57 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.866 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.6 44.92 1.48 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.45 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -170.74 -46.59 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -29.81 70.85 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -59.63 -33.34 71.38 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -65.44 -54.77 23.66 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.593 -0.692 . . . . 0.0 111.419 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -71.12 -32.73 69.37 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.5 t -67.05 -44.73 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -176.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 m -66.18 -37.57 85.93 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -53.32 -52.38 59.34 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.843 0.747 . . . . 0.0 112.263 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -29.69 -54.7 0.16 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -99.51 -34.87 10.08 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.9 t -62.21 -51.12 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.354 -0.841 . . . . 0.0 113.227 -175.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.12 -105.42 2.57 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.994 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 t -151.19 -73.98 0.15 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.552 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.4 p -140.37 132.72 28.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.7 t -143.81 138.9 15.58 Favored Pre-proline 0 N--CA 1.471 0.58 0 C-N-CA 120.179 -0.609 . . . . 0.0 109.366 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.39 134.22 12.45 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 121.726 1.617 . . . . 0.0 111.278 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.9 111.75 19.07 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 120.092 -0.643 . . . . 0.0 110.327 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.8 p -88.39 -60.21 2.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.149 -0.62 . . . . 0.0 111.057 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.605 -0.712 . . . . 0.0 110.199 179.084 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -124.32 96.69 41.26 Favored Pre-proline 0 N--CA 1.47 0.568 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 97.7 Cg_endo -84.0 168.2 12.25 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.557 1.505 . . . . 0.0 112.032 -175.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 3' ' ' PRO . 60.5 tp 170.14 97.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 167.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -104.81 156.4 18.04 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.93 0.871 . . . . 0.0 110.355 -174.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.3 t -85.46 131.82 34.32 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.38 0.609 . . . . 0.0 111.145 -176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -133.8 78.01 1.74 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.12 -160.12 0.64 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.435 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.27 100.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 169.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.08 -53.98 0.5 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.796 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.0 t -74.07 167.19 37.9 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 122.456 -0.437 . . . . 0.0 109.988 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.678 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 71.5 Cg_exo -66.12 175.23 4.98 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.402 1.401 . . . . 0.0 114.739 -169.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.0 m -67.98 142.78 55.86 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.46 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.71 -40.4 72.37 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.8 60.28 5.83 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.762 0.792 . . . . 0.0 110.728 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.9 p -156.53 143.62 18.86 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.08 -23.99 66.84 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -38.31 90.62 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 112.487 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -67.35 -39.94 85.8 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.747 -0.596 . . . . 0.0 112.025 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.81 -37.74 69.04 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.73 -43.98 87.37 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.472 -0.768 . . . . 0.0 112.693 176.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' SG ' ' A' ' 11' ' ' CYS . 97.4 t -72.89 -47.1 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.756 -0.59 . . . . 0.0 111.629 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 90.9 p -67.85 -24.66 65.29 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -83.93 -22.98 31.34 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 171.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -83.44 -32.11 26.24 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 118.335 -1.346 . . . . 0.0 112.117 168.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -66.34 -41.39 89.65 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 120.968 -1.083 . . . . 0.0 111.789 170.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.8 tpt85 -35.02 -52.53 0.56 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -35.12 -57.87 0.56 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -171.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -90.24 106.11 18.27 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -175.74 92.16 0.09 OUTLIER Glycine 0 N--CA 1.465 0.608 0 C-N-CA 119.181 -1.485 . . . . 0.0 111.57 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -86.28 -61.6 1.71 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.97 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.5 mt -125.02 -62.54 1.22 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.85 80.48 0.08 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -135.99 -53.58 0.75 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.526 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.15 -56.46 6.8 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 120.326 -0.549 . . . . 0.0 111.399 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -29.54 -53.97 0.14 Allowed 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -172.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -39.55 -55.88 1.75 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -172.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.9 -56.77 10.07 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.189 -0.605 . . . . 0.0 111.057 177.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -38.23 -51.62 1.47 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.72 -34.87 52.53 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -77.57 -28.5 51.77 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -178.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -96.81 -94.36 0.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 119.351 -0.94 . . . . 0.0 108.809 170.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -28.78 -64.21 0.1 Allowed 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 42.6 t -17.75 -69.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.12 142.26 3.4 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.7 m -83.11 98.24 9.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.011 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 55.4 p -14.28 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 -169.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.8 m 168.46 94.25 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.917 0 N-CA-C 103.854 -2.647 . . . . 0.0 103.854 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -84.6 99.44 0.74 Allowed 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.344 1.363 . . . . 0.0 110.848 -174.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.13 111.21 19.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.487 0.66 . . . . 0.0 110.285 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.5 p -90.61 129.1 36.77 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.584 0.707 . . . . 0.0 110.251 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.635 -0.697 . . . . 0.0 109.345 179.57 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 121.38 0.609 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -88.41 137.16 30.82 Favored Pre-proline 0 N--CA 1.47 0.528 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.292 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -80.98 83.97 2.1 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.679 1.586 . . . . 0.0 111.316 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.6 tp -97.23 96.18 8.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.772 0.796 . . . . 0.0 109.028 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -120.37 106.44 11.85 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -175.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.4 m -12.79 111.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -137.81 76.42 1.58 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.75 -168.3 1.55 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.763 0.792 . . . . 0.0 111.252 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -74.93 101.5 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.768 0.794 . . . . 0.0 108.971 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.72 40.41 5.31 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.069 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 19.9 t -117.38 148.73 43.3 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.613 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 84.2 Cg_exo -55.52 170.93 0.73 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.053 1.835 . . . . 0.0 114.732 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -65.71 161.72 20.09 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.523 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 tp -57.33 -59.21 5.47 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -89.62 79.92 6.74 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.386 1.089 . . . . 0.0 110.636 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.7 p -151.96 154.77 36.72 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -60.0 -39.59 86.29 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -41.43 89.92 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -66.15 -48.68 69.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.64 -33.08 72.27 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.273 -0.892 . . . . 0.0 113.148 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -50.31 64.85 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.419 -0.801 . . . . 0.0 112.291 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -74.08 -33.88 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.0 m -69.56 -39.82 77.16 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -65.96 -29.88 70.35 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.57 -47.21 82.46 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.649 -0.657 . . . . 0.0 111.974 176.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.41 -59.96 2.65 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.991 174.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -35.21 -49.23 0.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -58.66 -55.72 31.43 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -170.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -90.04 90.26 8.06 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.174 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 142.67 -35.06 1.75 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.512 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -14.72 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 -169.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.4 mt -143.09 -70.3 0.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.57 -81.01 0.08 OUTLIER Glycine 0 N--CA 1.467 0.722 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -177.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -87.01 83.22 7.54 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -158.15 -29.14 0.08 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.809 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -99.67 52.71 0.93 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.517 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -80.1 -49.54 11.6 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.023 172.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -75.71 -39.32 57.56 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.875 -0.516 . . . . 0.0 112.347 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.2 t -61.96 -43.54 98.63 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.532 -0.73 . . . . 0.0 112.914 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.4 m -68.23 -48.44 65.12 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 120.19 -0.604 . . . . 0.0 112.338 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.15 -41.62 73.6 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.05 -24.55 63.27 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -97.72 -96.62 0.21 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 168.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.613 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.8 t -19.92 -70.08 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 -170.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -94.54 87.05 1.07 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 80.4 p -15.5 -72.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.184 2.661 . . . . 0.0 118.184 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.3 m -82.96 131.55 35.18 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.515 0.674 . . . . 0.0 109.76 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.7 m -73.18 121.58 85.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.95 -178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.84 166.84 16.89 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.705 1.603 . . . . 0.0 111.599 -178.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.27 103.94 9.54 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.54 0.686 . . . . 0.0 110.181 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -91.94 113.76 26.12 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.373 0.606 . . . . 0.0 109.854 -178.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.39 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 121.502 0.668 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -143.27 91.66 6.92 Favored Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -63.63 123.2 11.64 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 121.727 1.618 . . . . 0.0 113.162 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -82.86 113.04 20.21 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -79.8 120.51 24.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.557 0.694 . . . . 0.0 110.614 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.437 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 30.1 p -81.79 111.68 18.24 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.965 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -92.65 73.1 5.04 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.894 0.854 . . . . 0.0 109.513 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.54 167.02 12.53 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.853 0.835 . . . . 0.0 110.494 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.1 -38.22 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.64 2.67 73.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 120.035 -1.078 . . . . 0.0 114.925 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.558 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.5 t -94.54 155.22 39.81 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 118.649 1.224 . . . . 0.0 110.424 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.558 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 50.4 Cg_exo -67.21 176.47 4.65 Favored 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 121.542 1.494 . . . . 0.0 113.871 -173.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.7 t -72.59 158.47 35.61 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.882 0.849 . . . . 0.0 111.356 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -61.11 -42.55 98.74 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -70.21 -26.85 64.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -175.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -74.51 148.98 40.46 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.866 0.841 . . . . 0.0 111.329 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.03 -19.49 65.7 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -176.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.88 91.3 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.375 -0.828 . . . . 0.0 112.712 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -68.86 -36.91 78.7 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.658 -0.651 . . . . 0.0 112.002 174.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -62.41 -42.25 99.3 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.679 -0.638 . . . . 0.0 112.226 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.33 -46.11 71.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.405 HG11 ' SG ' ' A' ' 44' ' ' CYS . 7.4 p -68.66 -29.56 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.8 p -64.17 -29.85 70.95 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.8 tptp -66.2 -41.88 89.56 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.578 -0.701 . . . . 0.0 111.761 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -64.23 -44.88 90.49 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 112.05 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.27 -31.13 72.12 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.6 tpt180 -63.18 -41.4 99.21 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.536 -0.727 . . . . 0.0 112.516 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -64.86 -36.85 85.67 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.597 -0.689 . . . . 0.0 112.416 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -81.83 126.15 31.53 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.772 0.796 . . . . 0.0 110.444 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.22 -125.76 8.23 Favored Glycine 0 N--CA 1.467 0.74 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.327 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -163.27 -67.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.402 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.49 -52.43 0.71 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.366 -0.533 . . . . 0.0 110.873 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.49 62.42 0.43 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.909 -1.139 . . . . 0.0 111.644 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -156.9 36.13 0.3 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.654 0.74 . . . . 0.0 111.893 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -161.05 -54.36 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -34.5 -42.32 0.14 Allowed 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -62.75 -57.83 9.58 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.583 -0.447 . . . . 0.0 112.02 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -63.04 -48.12 80.09 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.303 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.3 t -37.78 -59.52 0.81 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.36 -29.69 53.48 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.45 -27.28 69.17 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.939 -1.101 . . . . 0.0 113.811 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -97.08 -53.51 3.47 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.622 169.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -77.04 -45.38 27.34 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.488 -0.758 . . . . 0.0 112.935 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.545 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.0 t -77.59 142.92 38.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.938 0.875 . . . . 0.0 111.163 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.52 94.82 0.1 Allowed Glycine 0 CA--C 1.524 0.65 0 C-N-CA 119.898 -1.144 . . . . 0.0 110.629 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.5 m -92.01 88.39 6.55 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.644 0.735 . . . . 0.0 109.9 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.8 m -84.53 -55.0 4.36 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.481 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 76.7 p -75.31 154.25 86.1 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.913 177.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.54 76.16 4.68 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.681 1.587 . . . . 0.0 111.758 -176.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.1 95.84 0.97 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p 169.82 -54.1 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 168.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.149 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.943 -178.868 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -110.86 106.74 57.78 Favored Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.96 102.86 1.14 Allowed 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 121.426 1.417 . . . . 0.0 110.966 -174.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 43.3 tp -91.16 110.54 21.82 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -87.14 179.39 6.66 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.546 1.165 . . . . 0.0 112.025 -169.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.4 t -113.74 122.97 48.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.049 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -142.94 78.02 1.59 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 122.026 0.917 . . . . 0.0 108.56 174.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -87.0 -168.35 2.21 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.596 0.712 . . . . 0.0 110.848 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.9 mt -76.5 97.03 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.82 0.819 . . . . 0.0 109.038 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.57 47.74 3.4 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.734 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.578 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.2 t -117.3 150.68 46.8 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.578 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.2 Cg_exo -60.94 175.11 1.43 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 121.708 1.605 . . . . 0.0 114.305 -177.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.7 p -72.39 150.33 43.51 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.665 0.745 . . . . 0.0 110.862 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -69.02 -12.95 62.15 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -77.25 -33.94 55.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.407 -0.808 . . . . 0.0 111.889 174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.2 p -75.84 153.91 36.5 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.022 0.915 . . . . 0.0 111.44 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -67.57 -27.43 66.92 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -47.11 86.96 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.485 -0.759 . . . . 0.0 113.018 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.435 ' ND2' ' SG ' ' A' ' 11' ' ' CYS . 13.3 t-20 -70.75 -32.53 69.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.07 -34.54 76.48 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.522 -0.736 . . . . 0.0 112.619 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -35.09 79.98 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.531 -0.731 . . . . 0.0 112.887 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.15 -49.15 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 121.748 -0.595 . . . . 0.0 111.023 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -65.29 -29.8 70.6 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -67.29 -27.92 67.58 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 178.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -86.77 -37.83 17.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 118.827 -1.149 . . . . 0.0 112.496 168.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.1 m -66.63 -61.05 2.18 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.06 -1.025 . . . . 0.0 112.125 -178.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -36.89 -45.72 0.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.8 -29.55 64.97 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -176.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -64.57 -53.99 39.2 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.531 -0.731 . . . . 0.0 111.186 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.57 97.6 1.4 Allowed Glycine 0 N--CA 1.467 0.726 0 C-N-CA 119.966 -1.111 . . . . 0.0 112.094 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -145.16 101.02 3.56 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.73 157.27 18.57 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.908 0.861 . . . . 0.0 110.201 -175.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.71 -74.81 1.31 Allowed Glycine 0 N--CA 1.468 0.806 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -90.02 103.86 16.48 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -65.02 114.76 4.8 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -22.05 81.93 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 -169.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -88.17 -12.2 44.62 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -170.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.01 -62.23 1.62 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 118.323 -1.351 . . . . 0.0 108.188 167.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.7 t -43.4 -42.01 4.47 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 48.8 t -64.63 -51.35 63.11 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -68.98 -58.18 4.46 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.581 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -31.69 -67.92 0.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -91.51 52.73 2.12 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.277 0.561 . . . . 0.0 111.579 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.457 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.3 t -167.54 -58.94 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.28 -0.888 . . . . 0.0 110.241 179.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.13 83.62 0.11 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.462 ' O ' ' HB ' ' A' ' 47' ' ' THR . 28.0 t -92.09 159.97 15.43 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.89 -179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' A' ' 46' ' ' SER . 6.4 t 169.47 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.781 167.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.2 m -142.31 105.38 5.56 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -58.49 -53.01 4.46 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 121.974 1.782 . . . . 0.0 114.539 -178.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -19.73 104.61 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 95.2 p -87.85 -45.78 10.0 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.22 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.171 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.211 -177.821 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -152.25 151.05 26.81 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.761 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.453 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 79.5 Cg_endo -77.43 164.76 28.31 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 121.78 1.654 . . . . 0.0 111.824 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 3' ' ' PRO . 8.9 tt 170.34 118.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 167.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -98.4 172.17 7.71 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.512 0.673 . . . . 0.0 109.726 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 4.3 t -115.04 114.61 25.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.161 169.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -100.59 75.63 1.76 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.68 0.752 . . . . 0.0 110.44 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -107.21 153.8 22.16 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.575 0.702 . . . . 0.0 109.509 172.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.2 tp -68.08 -39.95 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.63 31.69 6.0 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.499 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.716 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 2.2 t -117.61 152.21 49.38 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.716 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 49.9 Cg_endo -71.19 -175.48 1.52 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.592 1.528 . . . . 0.0 112.882 -174.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -58.83 149.03 27.83 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.767 0.794 . . . . 0.0 112.563 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.5 mt -59.32 -47.02 86.97 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.643 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -85.04 96.06 9.29 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.393 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 p 169.82 162.32 0.06 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 166.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -61.68 -32.85 73.06 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -172.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.13 81.77 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.546 -0.722 . . . . 0.0 112.565 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -67.78 -40.22 83.99 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.654 -0.654 . . . . 0.0 112.442 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.23 -38.97 88.55 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.92 94.56 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.1 t -68.97 -45.42 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 O-C-N 121.771 -0.581 . . . . 0.0 111.377 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.3 p -63.02 -41.59 99.59 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -73.75 -30.93 63.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.57 -51.11 46.23 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.742 -0.599 . . . . 0.0 111.734 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.1 t -76.73 -28.62 55.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.718 -0.793 . . . . 0.0 113.021 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.52 -41.13 84.78 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.621 -0.674 . . . . 0.0 112.271 170.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -63.11 -36.28 83.07 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.74 -0.6 . . . . 0.0 112.523 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -69.87 -54.61 12.67 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.791 -0.568 . . . . 0.0 111.312 176.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 31' ' ' LYS . . . -94.81 -109.36 2.24 Favored Glycine 0 N--CA 1.468 0.807 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 57.6 tptt 169.52 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 167.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.5 mt -124.12 127.4 47.74 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.11 -147.91 14.08 Favored Glycine 0 CA--C 1.526 0.753 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.607 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.7 -35.38 65.15 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.229 -0.571 . . . . 0.0 112.513 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -18.37 -56.94 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.534 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 82.1 m-85 -58.86 -25.48 63.33 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -169.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -66.85 -57.58 6.72 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.121 -0.987 . . . . 0.0 111.4 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -68.99 -60.02 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.225 175.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.9 t -48.6 -29.38 4.23 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -172.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.8 m -87.08 -45.74 10.43 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 119.029 -1.069 . . . . 0.0 112.683 170.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.37 -41.31 51.66 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -178.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.44 -56.3 4.65 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.63 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -91.78 67.82 5.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.392 -0.818 . . . . 0.0 111.649 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 46.1 t -167.01 151.04 6.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 122.001 0.905 . . . . 0.0 109.968 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.3 -145.03 6.7 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 119.796 -1.192 . . . . 0.0 110.864 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.7 p -90.95 137.41 32.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.548 0.689 . . . . 0.0 110.302 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.2 m -75.83 -59.34 2.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.376 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -86.52 137.07 34.42 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.72 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.65 115.72 3.67 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.615 1.544 . . . . 0.0 111.071 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.47 118.37 23.71 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.324 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.9 p -149.38 133.58 17.31 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.647 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.174 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.512 -179.5 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -136.45 143.04 41.68 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.51 171.45 18.02 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 121.88 1.72 . . . . 0.0 111.717 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tt -77.92 110.49 12.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -80.57 94.2 6.23 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.772 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.2 t -25.32 120.33 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 117.09 2.255 . . . . 0.0 117.09 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -88.48 79.35 7.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.921 0.867 . . . . 0.0 109.749 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.11 162.09 13.69 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 122.034 0.921 . . . . 0.0 111.038 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -76.2 -66.85 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.093 -176.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.84 60.56 0.46 Allowed Glycine 0 N--CA 1.469 0.882 0 C-N-CA 120.151 -1.023 . . . . 0.0 111.872 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.656 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 13.9 t -117.46 154.77 50.61 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.656 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.9 Cg_exo -58.86 -176.16 0.09 OUTLIER 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.969 1.779 . . . . 0.0 115.464 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.2 m -57.77 144.63 37.68 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.658 0.742 . . . . 0.0 111.636 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.04 -56.5 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.408 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -91.36 68.83 5.91 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.301 1.048 . . . . 0.0 110.71 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.6 p -139.59 160.72 39.21 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.521 0.677 . . . . 0.0 109.254 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.31 -31.42 71.26 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.25 -54.63 9.02 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.58 -0.7 . . . . 0.0 112.004 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -68.95 -29.86 68.18 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -61.86 -39.46 91.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.414 -0.804 . . . . 0.0 112.216 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.19 -36.0 81.94 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 173.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.4 t -63.01 -48.68 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.821 -0.549 . . . . 0.0 111.132 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.8 m -64.79 -29.06 70.02 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 177.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -61.84 -54.2 45.43 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.7 -0.625 . . . . 0.0 112.112 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -73.5 -63.88 1.1 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.924 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.5 m -38.84 -43.08 0.9 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 116.925 2.194 . . . . 0.0 116.925 -174.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -48.1 -29.01 3.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -57.16 -31.89 65.85 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -177.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -132.88 121.38 22.8 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.603 -0.686 . . . . 0.0 109.591 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.24 22.09 2.18 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 120.626 -0.797 . . . . 0.0 114.612 175.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -17.72 -72.35 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -172.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.12 165.34 28.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.865 0.84 . . . . 0.0 110.62 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.44 -80.04 1.29 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 120.182 -1.009 . . . . 0.0 110.674 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.11 86.63 4.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.81 118.3 10.13 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -29.17 84.37 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -94.76 -15.05 24.14 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.681 -1.145 . . . . 0.0 114.073 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -87.23 -33.4 19.32 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 118.833 -1.147 . . . . 0.0 112.465 169.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.82 -47.25 85.45 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.377 -0.827 . . . . 0.0 112.606 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.8 m -77.45 -43.6 31.84 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -177.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -68.12 -39.77 82.66 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.586 -0.696 . . . . 0.0 112.774 -177.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -71.77 -45.83 60.34 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.662 -0.649 . . . . 0.0 112.352 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -79.47 -77.51 0.18 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.434 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.527 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 49.4 t -19.39 -70.31 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -170.098 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.27 94.46 1.98 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.668 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.6 m -76.98 106.34 8.6 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.585 0.707 . . . . 0.0 110.321 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 78.5 m -92.12 -59.45 2.1 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.336 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -146.17 142.85 18.11 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.87 125.97 20.85 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.062 1.841 . . . . 0.0 113.789 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -81.3 112.4 18.57 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.489 0.661 . . . . 0.0 110.193 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.1 p -152.68 133.69 14.13 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.583 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.527 -179.178 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 121.476 0.655 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -86.73 145.86 39.97 Favored Pre-proline 0 N--CA 1.471 0.599 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.295 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.09 70.59 5.97 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.573 1.515 . . . . 0.0 112.591 -172.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.2 tp -96.62 104.82 16.84 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -78.66 156.64 28.91 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.07 0.938 . . . . 0.0 110.804 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.442 ' SG ' HG12 ' A' ' 22' ' ' VAL . 4.7 m -67.79 139.64 56.62 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.018 0.913 . . . . 0.0 111.77 178.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -149.4 77.97 1.36 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 173.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.14 -179.35 5.06 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.8 0.81 . . . . 0.0 110.908 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.2 tt -65.06 -38.05 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.38 46.96 1.04 Allowed Glycine 0 CA--C 1.529 0.946 0 C-N-CA 120.239 -0.981 . . . . 0.0 112.003 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.536 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 48.5 t -117.27 145.55 36.22 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 169.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.536 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 91.3 Cg_exo -50.19 150.5 10.56 Favored 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.264 1.976 . . . . 0.0 114.815 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.7 t -78.4 -178.5 5.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.896 0.855 . . . . 0.0 111.859 -173.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.8 -42.67 89.62 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -85.76 70.21 10.67 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.887 0.851 . . . . 0.0 110.216 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -159.6 141.11 12.94 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.7 -34.62 77.53 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.74 -38.54 89.4 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -67.11 -29.13 68.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.95 -38.77 89.74 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.246 -0.909 . . . . 0.0 111.887 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.77 72.63 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.442 HG12 ' SG ' ' A' ' 6' ' ' CYS . 65.0 t -69.69 -47.08 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.603 -0.686 . . . . 0.0 110.985 175.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.7 t -63.45 -34.07 76.94 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.281 -0.568 . . . . 0.0 112.422 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.92 -36.64 70.43 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.007 -1.058 . . . . 0.0 112.377 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -76.68 -55.42 5.52 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.8 -0.562 . . . . 0.0 111.756 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.2 m -77.82 -52.21 9.27 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -60.41 -26.68 66.88 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -49.0 -29.92 5.43 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -63.88 -60.24 3.52 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.383 -0.823 . . . . 0.0 111.083 173.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.76 92.18 2.23 Favored Glycine 0 N--CA 1.468 0.81 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.996 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -157.41 125.09 5.33 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.611 ' H ' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -81.77 166.74 19.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.978 0.894 . . . . 0.0 112.28 -175.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.77 -113.47 4.73 Favored Glycine 0 N--CA 1.466 0.699 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -142.57 47.6 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.71 0.766 . . . . 0.0 110.707 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -93.19 4.7 53.54 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -99.98 -8.44 23.9 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.349 -0.941 . . . . 0.0 113.165 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -35.97 -55.06 0.76 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.73 -38.33 70.48 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -63.61 -38.87 92.76 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.589 -0.694 . . . . 0.0 112.796 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -64.48 -47.42 79.02 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.37 -30.55 66.28 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.44 -62.04 1.7 Allowed 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.468 -0.77 . . . . 0.0 110.344 177.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 44' ' ' CYS . 40.6 mt-30 -85.58 97.27 9.98 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.506 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.2 t 171.91 148.37 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 169.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.57 146.1 33.73 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 120.161 -1.018 . . . . 0.0 111.863 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.3 p -140.17 -64.23 0.48 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.848 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.5 m -76.69 123.61 26.41 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 177.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.2 m -14.25 97.1 0.04 OUTLIER Pre-proline 0 N--CA 1.481 1.12 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -168.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -84.73 105.07 0.97 Allowed 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 121.498 1.465 . . . . 0.0 110.824 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.43 110.82 18.49 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.045 -0.662 . . . . 0.0 110.278 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 t -92.01 105.28 17.56 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.629 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.171 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.548 -178.908 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -123.28 100.25 39.28 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.3 85.51 1.19 Allowed 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 121.549 1.499 . . . . 0.0 111.068 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.9 tp -147.88 72.56 1.23 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.276 1.036 . . . . 0.0 108.809 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -105.21 95.09 5.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.257 -174.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -8.71 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -125.59 76.45 1.57 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.861 -172.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.94 -172.99 2.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.774 169.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.92 102.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 122.192 0.996 . . . . 0.0 109.85 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.39 -82.98 0.25 Allowed Glycine 0 N--CA 1.467 0.748 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.89 145.21 0.07 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -174.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.552 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 74.8 Cg_exo -58.18 162.96 10.7 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 121.927 1.751 . . . . 0.0 114.784 -174.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.5 t -67.02 165.52 15.53 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.636 0.731 . . . . 0.0 111.526 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.08 -54.64 44.7 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.867 -0.52 . . . . 0.0 112.323 -174.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -87.83 79.47 8.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.911 0.862 . . . . 0.0 110.409 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.1 p -153.28 149.88 28.37 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.38 -40.2 89.98 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.48 77.95 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -64.28 -33.64 76.29 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.9 -41.72 96.64 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 111.908 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.93 92.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 175.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.436 HG21 ' SG ' ' A' ' 44' ' ' CYS . 67.5 t -66.41 -52.24 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 O-C-N 121.753 -0.592 . . . . 0.0 111.431 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.8 t -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -55.21 -42.12 72.92 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.148 -0.97 . . . . 0.0 112.528 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -76.19 -54.06 7.36 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.807 -0.558 . . . . 0.0 112.137 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.87 -38.42 45.98 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -173.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -67.93 -27.92 67.04 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -86.69 -61.16 1.8 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 118.884 -1.127 . . . . 0.0 111.443 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -92.2 118.79 31.2 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 0.0 109.937 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.14 36.8 5.6 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.359 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -92.91 70.69 4.68 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.757 -0.849 . . . . 0.0 109.311 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.8 mt -138.39 44.7 2.1 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.134 -176.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 80.44 -84.49 1.37 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.146 -1.026 . . . . 0.0 112.838 174.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.65 87.96 7.32 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 122.202 1.001 . . . . 0.0 109.867 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -166.32 -38.09 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.04 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.536 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 97.6 m-85 -72.52 -26.83 61.91 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -65.64 -49.55 68.28 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.167 -0.958 . . . . 0.0 111.356 177.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -68.19 -32.44 72.68 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.7 t -69.45 -47.1 65.1 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.386 -0.821 . . . . 0.0 112.585 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.536 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 5.6 m -71.69 -41.09 69.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.425 -0.797 . . . . 0.0 112.254 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -78.91 -29.5 44.25 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -99.04 -60.49 1.52 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.291 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -69.97 -71.04 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.498 -172.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.552 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 50.3 t -18.86 -72.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 -172.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.46 83.53 0.46 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -87.11 121.66 29.87 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.535 0.683 . . . . 0.0 110.1 -177.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 69.1 p -71.86 -47.1 55.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.9 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -137.03 94.15 12.83 Favored Pre-proline 0 N--CA 1.469 0.503 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -81.73 105.59 1.56 Allowed 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.565 1.51 . . . . 0.0 110.921 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.33 117.35 22.94 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.325 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.6 p -148.07 -62.65 0.26 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.289 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.171 179.494 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -91.69 133.35 31.08 Favored Pre-proline 0 N--CA 1.47 0.555 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -82.38 85.84 1.59 Allowed 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 121.579 1.519 . . . . 0.0 111.491 -174.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 tt -96.3 106.39 18.6 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -135.52 109.09 7.94 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.9 m -13.06 118.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -146.39 83.73 1.62 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 170.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.28 -153.76 0.16 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.519 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.7 mm -71.83 -58.88 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.275 -0.89 . . . . 0.0 110.782 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -76.86 -55.9 4.31 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.836 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.605 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.68 139.28 0.16 Allowed Pre-proline 0 N--CA 1.477 0.881 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -170.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.618 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 39.6 Cg_endo -67.43 176.95 4.31 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 121.738 1.625 . . . . 0.0 113.431 -173.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.3 p -74.12 153.29 39.64 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.656 0.741 . . . . 0.0 111.265 -175.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.763 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -71.14 -3.64 21.06 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.214 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -97.31 -19.08 18.77 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.446 -0.784 . . . . 0.0 112.915 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -75.84 146.69 39.67 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.205 -0.934 . . . . 0.0 110.932 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.02 -41.46 71.38 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -172.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.01 76.91 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -71.25 -35.33 71.37 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.75 -30.44 70.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.246 -0.909 . . . . 0.0 112.893 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.09 33.1 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.26 -0.9 . . . . 0.0 112.051 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.0 p -67.64 -39.67 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.6 p -75.88 -35.55 59.83 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -176.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -66.48 -29.79 69.98 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.81 -52.29 66.08 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.469 -0.769 . . . . 0.0 112.223 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.9 m -76.94 -31.75 56.84 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -66.36 -43.67 85.35 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.994 -1.066 . . . . 0.0 112.257 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -67.62 -43.88 79.36 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.66 -0.65 . . . . 0.0 112.149 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -120.95 100.15 6.91 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -53.97 0.31 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 119.89 -1.148 . . . . 0.0 111.309 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -15.04 100.17 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.6 tp -160.86 -62.27 0.06 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.918 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.37 -68.46 0.29 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.127 -1.189 . . . . 0.0 110.127 -174.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 19.4 m-20 -85.49 85.12 7.45 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 38.8 t70 172.86 11.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.2 168.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.481 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 95.9 m-85 -101.3 -29.79 11.86 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.581 -1.324 . . . . 0.0 112.295 169.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -70.23 -50.04 43.93 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.149 -0.969 . . . . 0.0 110.918 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.492 ' HE ' ' HA ' ' A' ' 35' ' ' ASP . 38.3 ptt180 -67.68 -39.65 84.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.4 t -65.46 -43.89 88.91 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.485 -0.76 . . . . 0.0 113.051 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.481 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 73.5 m -63.69 -62.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.853 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -42.33 -62.65 0.91 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -174.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -36.95 -62.15 0.51 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -173.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -91.74 -12.15 34.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.618 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.9 t -147.56 128.33 14.33 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.136 -0.977 . . . . 0.0 110.522 -174.275 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.3 -104.58 3.12 Favored Glycine 0 N--CA 1.466 0.698 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.464 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.4 m -88.15 87.15 7.23 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.72 0.771 . . . . 0.0 109.4 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 66.4 p -77.78 121.51 24.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.528 0.68 . . . . 0.0 110.741 -173.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.5 p -95.57 119.92 64.4 Favored Pre-proline 0 N--CA 1.47 0.567 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -58.35 124.58 16.2 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 121.894 1.729 . . . . 0.0 113.619 -178.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.82 131.14 7.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.476 0.655 . . . . 0.0 109.317 179.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.8 p -89.73 94.9 10.01 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.041 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.547 -179.06 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 CA-C-O 121.674 0.75 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -78.59 149.21 74.52 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.559 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -77.66 -35.87 1.38 Allowed 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 121.69 1.594 . . . . 0.0 114.042 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.8 tp -14.22 100.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -94.37 161.43 14.24 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.858 0.837 . . . . 0.0 110.215 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 t -82.5 85.29 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -124.8 77.26 1.59 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.014 -0.675 . . . . 0.0 110.199 -171.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.421 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . . . -92.08 -106.16 0.11 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.629 -0.829 . . . . 0.0 109.451 173.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.5 mm -90.41 -69.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -171.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.78 -50.98 4.2 Favored Glycine 0 N--CA 1.47 0.923 0 C-N-CA 120.126 -1.035 . . . . 0.0 113.71 -172.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 19' ' ' ASN . 7.3 t -20.85 133.87 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -170.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.728 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 71.2 Cg_exo -54.43 170.98 0.46 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.329 2.019 . . . . 0.0 114.941 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -61.68 164.81 5.67 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 122.123 0.963 . . . . 0.0 112.698 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -171.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -99.61 52.05 0.93 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.781 -174.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.2 p -108.21 166.36 10.8 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.778 0.799 . . . . 0.0 110.178 176.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.32 -44.62 78.71 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.423 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.17 81.18 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 11' ' ' CYS . 13.0 t-20 -65.46 -29.8 70.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.7 -41.46 90.8 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.407 -0.808 . . . . 0.0 113.124 -178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.03 69.74 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.562 -0.711 . . . . 0.0 112.817 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HB2' ' A' ' 44' ' ' CYS . 14.8 p -70.01 -39.79 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.5 p -66.36 -21.95 66.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -82.48 -23.34 34.76 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 171.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -85.64 -49.73 7.77 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.47 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.94 -28.34 64.41 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -67.44 -26.05 66.21 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.954 -1.091 . . . . 0.0 113.279 171.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -84.08 -44.22 14.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 118.852 -1.139 . . . . 0.0 111.117 168.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -85.21 71.76 10.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.222 -0.924 . . . . 0.0 109.189 171.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -132.64 125.1 4.04 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -83.98 -101.48 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.022 -0.671 . . . . 0.0 109.432 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.7 mt -140.4 76.19 1.54 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.77 -44.73 3.39 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 119.923 -1.132 . . . . 0.0 113.843 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -68.18 -69.03 0.35 Allowed 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.985 -0.715 . . . . 0.0 111.914 -174.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -19.47 -67.1 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 -173.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -35.32 -47.37 0.41 Allowed 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -174.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -35.39 -53.65 0.65 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -175.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -66.4 -61.21 2.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.444 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.8 t -37.07 -49.13 0.84 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 3.1 m -72.49 -35.63 68.21 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -175.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -72.35 -48.55 41.03 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.294 -0.879 . . . . 0.0 111.323 175.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -81.44 -96.27 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -34.14 -53.2 0.48 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -173.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.728 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 43.5 t -69.67 -60.71 2.15 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.78 -132.38 5.62 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.773 -176.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 81.3 p -156.93 143.46 18.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.576 0.703 . . . . 0.0 109.547 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.6 p -137.86 131.83 31.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.644 0.735 . . . . 0.0 109.068 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.4 t -87.77 138.33 31.44 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.878 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.97 98.47 1.12 Allowed 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 121.635 1.557 . . . . 0.0 110.996 -177.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.63 112.57 2.44 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -15.86 108.1 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 -169.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.28 179.434 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.47 124.79 56.28 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.231 -0.587 . . . . 0.0 109.544 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -81.45 -48.21 0.06 OUTLIER 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.582 1.521 . . . . 0.0 112.559 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.5 tp -15.3 107.57 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 117.734 2.494 . . . . 0.0 117.734 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -99.36 139.24 35.31 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.962 175.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.8 t -83.92 93.72 8.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.712 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -97.76 78.51 2.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.833 0.825 . . . . 0.0 109.234 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 155.54 32.28 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.636 0.732 . . . . 0.0 110.762 177.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.59 110.63 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 121.871 0.843 . . . . 0.0 109.9 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.3 -42.39 1.82 Allowed Glycine 0 CA--C 1.53 1.013 0 C-N-CA 120.237 -0.982 . . . . 0.0 112.001 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.2 m -80.74 169.47 19.39 Favored Pre-proline 0 CA--C 1.542 0.645 0 O-C-N 122.096 -0.649 . . . . 0.0 110.71 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -58.63 152.84 53.03 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 121.877 1.718 . . . . 0.0 115.44 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -76.68 164.43 25.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.556 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.1 tp -50.29 -50.4 50.56 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -173.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -90.84 36.75 0.91 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.737 -0.785 . . . . 0.0 112.834 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.6 p -109.98 151.25 27.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.954 0.883 . . . . 0.0 110.451 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.33 -33.54 75.74 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.64 -55.68 24.75 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.718 -0.613 . . . . 0.0 111.215 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 22' ' ' VAL . 20.5 t-20 -37.92 -40.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -177.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.9 mp -54.13 -38.41 65.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.46 -43.42 66.68 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 19' ' ' ASN . 8.1 p -65.23 -22.75 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 176.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -82.42 -55.19 4.65 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 118.224 -1.39 . . . . 0.0 109.493 167.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -36.14 -54.98 0.79 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -175.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.93 -46.42 24.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -177.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.4 m -63.07 -50.24 71.37 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.548 -0.72 . . . . 0.0 112.385 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -55.85 -32.68 63.84 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.8 -29.31 68.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 175.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -76.04 95.33 3.59 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.67 0.748 . . . . 0.0 110.043 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.41 -130.61 9.95 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.468 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -163.76 -56.19 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.331 -0.548 . . . . 0.0 109.964 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.2 tp -145.38 111.75 5.74 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.75 -167.08 37.23 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.719 -1.229 . . . . 0.0 111.846 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -89.49 15.37 9.43 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.15 -27.93 57.18 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.232 -0.918 . . . . 0.0 112.614 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.451 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 22.6 m-85 -71.6 -24.74 61.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -172.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.34 -49.3 77.51 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.416 -0.803 . . . . 0.0 112.072 -177.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -63.45 -39.2 93.85 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.675 -0.641 . . . . 0.0 112.455 176.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.0 t -61.47 -44.95 96.18 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 4.4 m -73.69 -29.21 62.15 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.95 -26.85 66.32 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 172.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -92.39 -98.91 0.13 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 167.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -36.57 112.85 0.2 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 52.7 t -158.79 -63.18 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.268 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.94 -88.68 0.07 OUTLIER Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 80.6 p -86.19 90.4 8.13 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.806 0.812 . . . . 0.0 109.172 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -144.86 -62.93 0.36 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.9 t -85.08 136.09 38.71 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 120.194 -0.602 . . . . 0.0 109.942 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.51 107.82 2.21 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 121.675 1.583 . . . . 0.0 111.043 -176.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.07 -55.94 4.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.723 -178.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.6 m -15.57 109.45 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -169.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.732 179.088 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -123.39 94.11 47.02 Favored Pre-proline 0 N--CA 1.47 0.565 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.401 ' O ' ' C ' ' A' ' 4' ' ' LEU . 79.5 Cg_endo -82.73 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.532 0.388 0 C-N-CA 121.642 1.561 . . . . 0.0 110.437 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 3' ' ' PRO . 44.2 tp -15.76 109.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -169.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -84.18 85.86 7.3 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.809 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -26.14 121.18 0.07 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.578 2.066 . . . . 0.0 116.578 -175.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -89.36 78.97 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.749 0.785 . . . . 0.0 109.852 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.83 154.51 35.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.69 0.757 . . . . 0.0 110.144 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.4 mm -81.03 99.86 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-O 121.667 0.746 . . . . 0.0 109.937 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.81 -82.65 0.15 Allowed Glycine 0 N--CA 1.467 0.726 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.8 t -35.19 150.75 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -171.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 87.9 Cg_exo -55.87 -173.29 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.4 2.067 . . . . 0.0 116.541 -174.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.7 m -50.91 146.33 6.17 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.436 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.6 tp -55.8 -51.91 65.83 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -100.08 81.9 2.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.694 0.759 . . . . 0.0 109.282 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -143.67 171.27 14.42 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.842 0.829 . . . . 0.0 110.341 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -67.58 -43.0 81.65 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.761 -0.587 . . . . 0.0 112.36 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.57 -45.21 80.05 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.733 -0.604 . . . . 0.0 112.462 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.7 -31.53 72.59 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.3 tp -64.32 -41.7 96.68 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.297 -0.877 . . . . 0.0 112.297 175.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.23 76.46 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.636 -0.665 . . . . 0.0 112.785 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.542 HG11 ' SG ' ' A' ' 11' ' ' CYS . 14.6 p -62.72 -41.43 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.691 -0.631 . . . . 0.0 112.396 178.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.9 p -66.43 -29.93 70.18 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -67.06 -28.61 68.34 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -86.71 -63.21 1.35 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 118.293 -1.363 . . . . 0.0 109.76 167.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.433 ' SG ' HG22 ' A' ' 22' ' ' VAL . 73.1 m -37.25 -47.84 0.83 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.378 1.992 . . . . 0.0 116.378 -174.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -51.76 -29.16 17.64 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -57.31 -29.31 63.82 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -71.34 176.19 4.8 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.96 0.886 . . . . 0.0 110.662 175.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.4 120.02 17.78 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 120.392 -0.909 . . . . 0.0 113.298 -174.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 ttmt -84.52 95.69 8.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.698 0.761 . . . . 0.0 110.084 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -113.1 -45.27 3.18 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.95 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.36 -89.12 0.08 OUTLIER Glycine 0 CA--C 1.523 0.575 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -101.21 44.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.676 0.751 . . . . 0.0 110.376 172.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -96.39 3.63 52.75 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.606 -0.684 . . . . 0.0 112.54 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -99.68 -1.65 37.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.695 169.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -34.05 -54.3 0.48 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -68.29 -57.46 5.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.02 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 23.0 t -40.02 -38.46 0.72 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 117.571 2.434 . . . . 0.0 117.571 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.3 m -90.18 -24.63 20.97 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 172.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -86.22 -25.71 25.46 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -96.58 -46.89 6.15 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.149 -0.969 . . . . 0.0 112.139 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -99.18 71.03 1.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 118.993 -1.083 . . . . 0.0 110.719 170.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.617 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.7 t 169.46 -74.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 166.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.52 79.15 1.44 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.39 -178.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.6 p -148.49 112.53 5.18 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 64.2 p -13.89 106.09 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.6 m -143.62 96.68 5.61 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -83.13 103.34 1.15 Allowed 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 121.541 1.494 . . . . 0.0 110.864 -175.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.98 104.44 14.05 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.569 0.7 . . . . 0.0 110.305 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 78.8 p -89.79 -58.24 2.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.209 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.203 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.312 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.475 0.805 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -82.72 155.04 68.44 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.986 178.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -79.59 82.36 2.52 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 121.657 1.572 . . . . 0.0 110.967 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.0 tp -157.0 113.31 2.98 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.584 0.707 . . . . 0.0 109.276 -177.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.15 147.87 26.4 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.3 t -85.22 107.56 17.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.058 -173.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -99.92 80.65 2.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.696 0.76 . . . . 0.0 109.447 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.59 -149.28 0.25 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.603 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.51 111.6 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 169.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.84 38.0 6.65 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.414 -0.898 . . . . 0.0 113.337 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.648 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.6 t -117.93 153.22 50.96 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.648 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -56.49 175.75 0.25 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.093 1.862 . . . . 0.0 114.852 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 75.3 p -59.93 149.21 32.43 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.592 0.71 . . . . 0.0 111.461 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.84 -47.03 77.98 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -171.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.16 0.1 46.82 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -177.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -73.12 161.12 30.99 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.902 -1.124 . . . . 0.0 111.626 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -67.63 -33.16 74.42 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.08 -43.57 86.96 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.591 -0.693 . . . . 0.0 112.53 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -66.96 -36.55 82.45 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.644 -0.66 . . . . 0.0 112.313 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.72 -42.63 99.75 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.67 -0.644 . . . . 0.0 111.701 175.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.32 -43.18 99.41 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.79 -37.49 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.55 -0.719 . . . . 0.0 112.469 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -64.01 -35.11 79.65 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.531 -0.731 . . . . 0.0 112.096 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -57.36 -40.56 78.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -68.39 -63.95 0.96 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.528 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.0 m -41.97 -43.48 3.15 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.1 -28.77 69.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -178.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -57.97 -26.24 62.06 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.56 -49.75 76.54 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.72 -0.613 . . . . 0.0 112.054 176.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 133.96 83.79 0.21 Allowed Glycine 0 N--CA 1.468 0.82 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 178.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -14.2 100.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -168.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -89.56 -53.6 4.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.628 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.71 -73.76 0.41 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 -171.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -86.64 73.41 10.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.42 1.105 . . . . 0.0 109.895 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -157.52 -41.59 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.168 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -65.81 -31.75 72.88 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.76 -52.43 56.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.564 -0.71 . . . . 0.0 111.48 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -68.55 -38.36 80.72 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.699 -0.626 . . . . 0.0 112.606 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -55.79 -52.98 62.09 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.8 m -77.86 -33.62 52.08 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -62.06 -28.58 69.71 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -95.87 -35.34 11.51 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 119.102 -1.039 . . . . 0.0 112.538 171.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.9 -78.6 0.1 Allowed 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.205 -0.935 . . . . 0.0 110.126 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.587 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 33.9 t -18.8 -70.3 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.338 2.347 . . . . 0.0 117.338 -173.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -107.27 -84.07 1.64 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.6 p 169.22 69.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 166.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 62.7 m -100.88 139.44 36.56 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 57.7 m -133.81 99.82 13.73 Favored Pre-proline 0 N--CA 1.469 0.523 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.99 110.24 2.05 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.532 1.488 . . . . 0.0 110.916 -174.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.9 120.46 4.2 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 90.6 p -89.91 119.49 30.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.056 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.576 -179.051 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.74 141.2 14.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -55.23 111.98 0.91 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.214 1.942 . . . . 0.0 114.283 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp -151.51 101.57 2.82 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -97.0 131.4 43.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.825 0.822 . . . . 0.0 110.065 -170.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 23' ' ' SER . 28.8 p -85.82 100.17 11.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.843 -172.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -98.63 85.78 3.42 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 172.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.96 -148.21 0.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.81 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.8 mt -116.67 100.96 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 169.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 140.99 -54.13 0.64 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.217 -0.992 . . . . 0.0 110.686 -173.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.593 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.0 t -77.76 161.52 71.28 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.297 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.593 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 52.1 Cg_exo -71.16 -174.67 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 CA-C-N 120.816 1.327 . . . . 0.0 114.352 -169.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -73.44 146.77 44.76 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.512 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -18.97 64.59 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -175.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -72.61 -31.17 64.97 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.47 -0.769 . . . . 0.0 112.357 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.0 p -73.75 149.28 41.88 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.739 0.781 . . . . 0.0 111.29 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -67.52 -24.26 65.54 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.28 -43.72 98.18 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.55 -0.718 . . . . 0.0 112.717 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -73.79 -29.4 62.15 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.944 -0.702 . . . . 0.0 112.301 177.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.8 -43.47 98.73 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.353 -0.842 . . . . 0.0 112.591 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.42 -42.68 82.82 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.577 HG21 ' SG ' ' A' ' 11' ' ' CYS . 30.1 m -68.76 -25.3 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.509 ' HB2' ' SG ' ' A' ' 6' ' ' CYS . 10.4 t -85.59 -26.91 25.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 118.848 -1.141 . . . . 0.0 113.19 168.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -50.42 -44.07 55.13 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.393 0.997 . . . . 0.0 113.257 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.02 -62.0 1.74 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.752 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.4 m -44.43 -34.39 2.02 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -85.35 -39.43 17.65 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 172.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -66.15 -57.97 6.46 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.997 -1.065 . . . . 0.0 110.761 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -108.6 88.44 2.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.04 -60.19 0.28 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 119.24 -1.457 . . . . 0.0 112.764 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -15.26 111.15 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -168.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -154.33 -51.89 0.09 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.146 -0.621 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.26 -72.21 0.25 Allowed Glycine 0 N--CA 1.466 0.683 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -174.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -67.74 -50.14 58.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.781 173.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -18.91 -57.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -53.03 -54.41 35.71 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -172.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -38.89 -61.49 0.73 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -72.89 -36.96 67.44 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -54.1 -51.43 64.22 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.0 m -77.19 -52.59 8.98 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.409 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -54.7 -37.26 65.62 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -69.54 -56.73 6.53 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.526 -0.734 . . . . 0.0 110.982 175.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.57 56.22 3.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.761 -0.587 . . . . 0.0 111.649 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t -166.75 -61.73 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.49 -0.756 . . . . 0.0 109.761 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.23 83.17 0.16 Allowed Glycine 0 N--CA 1.466 0.654 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 178.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.6 t -92.1 129.67 38.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.629 0.728 . . . . 0.0 110.949 -173.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 74.1 p -72.71 -38.76 67.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.777 175.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 77.3 m -133.19 96.83 17.03 Favored Pre-proline 0 N--CA 1.469 0.518 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -60.15 150.2 80.68 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.997 1.798 . . . . 0.0 114.084 -175.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.26 -65.5 0.17 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.0 177.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.0 m -88.96 144.62 26.05 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.589 0.709 . . . . 0.0 110.234 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.327 179.529 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 111.434 0.161 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -137.68 145.28 48.11 Favored Pre-proline 0 N--CA 1.471 0.623 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -74.74 122.11 7.11 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 121.779 1.653 . . . . 0.0 110.713 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 tt -145.88 105.85 4.01 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -94.29 142.13 27.76 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.861 0.838 . . . . 0.0 109.01 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 11.9 t -76.63 135.1 39.15 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.934 -171.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -89.36 83.28 6.41 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.22 143.26 33.19 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.697 0.761 . . . . 0.0 110.013 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.5 pt -73.85 -24.73 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.49 60.49 0.54 Allowed Glycine 0 N--CA 1.469 0.86 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.926 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.718 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 15.1 t -116.93 156.0 48.63 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 169.121 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.718 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 85.0 Cg_exo -59.9 -179.71 0.23 Allowed 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.801 1.667 . . . . 0.0 115.535 -174.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -62.58 163.78 8.5 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.79 0.805 . . . . 0.0 112.612 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.5 tp -57.68 -50.72 72.25 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -171.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -94.35 50.29 1.36 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.999 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.9 p -112.85 169.53 8.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.833 0.825 . . . . 0.0 110.296 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.03 -40.97 78.29 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.135 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.5 -44.05 75.56 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -64.52 -33.08 75.06 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.52 -41.21 89.17 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.507 -0.745 . . . . 0.0 112.159 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.26 -62.21 1.5 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.58 -0.7 . . . . 0.0 111.317 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.1 p -42.19 -46.21 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -174.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -71.25 -40.4 71.02 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -63.25 -38.04 89.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.79 -63.92 0.96 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.421 -0.799 . . . . 0.0 109.769 176.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -44.3 -40.07 4.99 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -56.89 -46.72 81.71 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -67.57 -57.92 5.61 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.772 -0.58 . . . . 0.0 111.143 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -96.5 82.27 3.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 141.55 40.23 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 120.22 -0.991 . . . . 0.0 112.934 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -87.45 81.79 7.71 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.998 -0.707 . . . . 0.0 109.163 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -138.24 -58.62 0.64 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.722 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.04 -68.86 0.5 Allowed Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -172.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -89.8 78.6 6.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 122.455 1.121 . . . . 0.0 108.867 175.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -161.14 -56.98 0.05 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.466 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 90.8 m-85 -38.78 -40.43 0.62 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -174.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -57.96 -47.56 82.57 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -67.78 -41.32 83.44 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.65 -0.656 . . . . 0.0 112.116 176.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -59.39 -45.64 90.9 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 22.6 m -77.22 -40.72 44.02 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -175.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -68.2 -29.82 68.77 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -68.97 -48.7 62.52 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.392 -0.817 . . . . 0.0 111.84 178.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.62 -57.16 3.45 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.805 -0.559 . . . . 0.0 110.967 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 42.6 t -85.59 148.19 26.04 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 122.016 0.912 . . . . 0.0 111.34 -176.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.42 74.57 1.29 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.738 178.095 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.1 t -92.01 -65.51 1.0 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.575 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.46 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.5 m -14.3 105.1 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 -169.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' A' ' 47' ' ' THR . 8.7 t 169.52 136.99 0.06 OUTLIER Pre-proline 0 N--CA 1.477 0.907 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 166.258 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -54.81 122.84 12.36 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.017 1.812 . . . . 0.0 113.619 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.96 125.3 5.1 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.8 t -16.33 -72.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -169.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.145 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.163 -176.955 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 121.465 0.65 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -154.4 148.03 18.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.46 93.38 1.08 Allowed 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 121.784 1.656 . . . . 0.0 111.065 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.0 tp -152.7 116.54 4.82 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -131.19 165.4 23.42 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.39 137.47 56.9 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.32 -0.862 . . . . 0.0 111.665 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -131.71 76.92 1.74 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 171.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -94.64 -176.49 3.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.922 0.868 . . . . 0.0 111.048 -176.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.9 mm -71.39 -56.68 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.765 -0.585 . . . . 0.0 111.113 -175.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.59 33.94 5.83 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 120.021 -1.085 . . . . 0.0 113.997 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.9 t -116.87 160.4 36.95 Favored Pre-proline 0 CA--C 1.543 0.682 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.1 Cg_exo -67.61 -178.32 1.51 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 CA-C-N 121.082 1.422 . . . . 0.0 114.099 -171.113 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.3 t -66.23 158.39 29.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.725 0.774 . . . . 0.0 111.594 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.57 -55.23 37.51 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.346 -173.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.41 80.44 8.13 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.927 0.87 . . . . 0.0 110.24 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.9 p -153.81 153.85 32.89 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.549 0.69 . . . . 0.0 109.396 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.42 -36.47 84.27 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -48.5 73.26 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.667 -0.645 . . . . 0.0 112.256 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -63.17 -37.23 86.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.721 -0.612 . . . . 0.0 112.605 175.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.17 -44.17 95.25 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.895 -0.503 . . . . 0.0 111.727 178.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.96 -39.15 93.82 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.653 0.982 . . . . 0.0 113.653 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.0 t -59.6 -49.56 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 O-C-N 121.64 -0.662 . . . . 0.0 111.196 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 95.0 p -66.0 -30.4 70.94 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -61.85 -28.41 69.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -88.25 -55.35 3.78 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 118.769 -1.172 . . . . 0.0 112.896 169.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.7 m -77.99 -47.07 19.36 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -171.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -57.71 -29.37 64.65 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.59 -28.01 65.18 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -77.55 93.27 4.15 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.488 -0.757 . . . . 0.0 110.05 177.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.59 -133.37 11.63 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 119.959 -1.115 . . . . 0.0 111.065 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -164.75 -56.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.094 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -78.28 152.72 32.34 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 122.013 0.911 . . . . 0.0 111.523 -171.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.1 71.9 2.31 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.188 -1.006 . . . . 0.0 113.063 -175.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -141.43 55.86 1.52 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 122.256 1.027 . . . . 0.0 108.424 170.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -174.16 -41.77 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.333 -174.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -68.35 -22.56 64.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -31.31 -51.25 0.18 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -173.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -61.49 -63.53 1.24 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.582 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 14.5 t -38.73 -49.9 1.62 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 17.0 t -68.81 -27.46 65.88 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -87.13 -61.66 1.67 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.019 166.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -28.52 -63.73 0.1 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -88.0 -50.94 6.09 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.465 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.485 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 51.4 t -75.01 118.68 18.24 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 122.146 0.974 . . . . 0.0 110.841 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.13 65.45 1.59 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.381 -0.914 . . . . 0.0 111.174 -174.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.5 t -16.04 -78.93 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 -168.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.5 m -13.55 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 -168.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.5 t -160.53 140.94 8.58 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.506 -178.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.05 121.66 6.3 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 121.764 1.643 . . . . 0.0 110.887 179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.7 -54.09 6.46 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.111 -0.636 . . . . 0.0 111.802 -178.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.9 p -85.87 135.01 33.87 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.6 0.714 . . . . 0.0 110.5 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.336 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 121.643 0.735 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -126.47 165.7 18.62 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 122.211 1.005 . . . . 0.0 109.736 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.4 t -78.89 145.73 33.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.139 0.971 . . . . 0.0 112.891 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -141.01 75.87 1.52 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 169.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.42 -171.82 2.75 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.567 0.699 . . . . 0.0 110.879 -175.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.8 mm -73.32 -64.25 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.586 -0.696 . . . . 0.0 111.01 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.54 -58.91 3.7 Favored Glycine 0 N--CA 1.469 0.869 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.471 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -39.44 155.61 0.15 Allowed Pre-proline 0 N--CA 1.476 0.859 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.35 147.15 12.52 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.274 1.982 . . . . 0.0 114.928 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -67.19 162.36 22.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.683 0.754 . . . . 0.0 111.476 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.9 tp -55.24 -46.48 76.01 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -169.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -102.02 42.38 1.14 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.534 -175.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.7 p -106.8 158.56 16.9 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.386 -0.821 . . . . 0.0 110.124 175.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -63.64 -39.91 95.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.435 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.47 69.95 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.0 -39.57 94.41 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.2 -39.2 74.91 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.505 -0.747 . . . . 0.0 112.544 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.26 -50.53 60.12 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.58 -0.7 . . . . 0.0 112.633 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -73.18 -39.24 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.6 p -71.42 -31.86 67.72 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -66.12 -32.43 73.88 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.538 -0.726 . . . . 0.0 112.574 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -63.08 -45.73 90.72 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.596 -0.69 . . . . 0.0 111.776 174.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.9 m -69.93 -35.53 74.6 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.75 -40.43 97.24 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.578 -0.701 . . . . 0.0 112.261 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.36 -37.99 89.46 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -76.13 126.31 30.76 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.958 0.885 . . . . 0.0 110.521 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.24 -134.93 17.7 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.738 179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -165.49 -67.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -154.27 105.42 2.69 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.99 -114.51 0.45 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.146 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.4 -55.01 4.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.757 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -18.67 -67.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -38.69 -40.67 0.63 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 -170.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -72.56 -51.27 20.56 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.236 -0.915 . . . . 0.0 111.951 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -72.03 -25.6 61.87 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.5 t -84.75 -24.16 28.93 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 171.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.6 t -85.92 -23.74 26.86 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 170.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -84.93 -33.62 22.66 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 118.726 -1.19 . . . . 0.0 112.384 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.45 -50.88 19.38 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.967 -1.083 . . . . 0.0 111.143 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -98.7 92.41 5.57 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 167.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.468 0.464 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.926 -173.339 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.406 HD23 ' C ' ' A' ' 4' ' ' LEU . 6.4 tt . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -90.13 142.39 27.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.106 0.955 . . . . 0.0 111.148 -170.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.506 ' H ' ' HB3' ' A' ' 23' ' ' SER . 4.3 t -67.45 109.08 3.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.414 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -134.39 78.52 1.76 Allowed 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 175.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -81.49 -102.54 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.894 -176.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.587 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -118.61 107.8 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 119.673 -0.811 . . . . 0.0 108.83 169.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.04 -49.61 1.14 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 120.124 -1.036 . . . . 0.0 113.122 176.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 3.5 m -27.37 145.28 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 116.893 2.182 . . . . 0.0 116.893 -169.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -48.63 163.99 0.24 Allowed 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.667 2.245 . . . . 0.0 116.887 -173.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.6 m -57.08 145.49 30.68 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.862 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 14' ' ' LEU . 7.4 mp -53.02 -51.46 61.62 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -175.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -98.04 75.12 2.32 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.845 0.831 . . . . 0.0 110.192 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.7 p -148.27 165.98 29.36 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.583 0.706 . . . . 0.0 109.615 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -65.16 -35.31 80.71 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -46.13 67.43 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.406 -0.809 . . . . 0.0 111.971 177.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.429 ' HA ' HG12 ' A' ' 22' ' ' VAL . 18.0 t-20 -65.13 -29.72 70.59 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -57.63 -47.51 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.686 -0.634 . . . . 0.0 112.286 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.55 -62.57 1.39 Allowed 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.445 -0.785 . . . . 0.0 111.083 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 19' ' ' ASN . 7.9 p -53.37 -28.8 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.506 ' HB3' ' H ' ' A' ' 6' ' ' CYS . 89.6 p -86.51 -29.84 22.42 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -62.68 -25.99 68.43 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.953 -1.092 . . . . 0.0 113.15 171.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -85.86 -43.82 12.95 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.926 168.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.66 -41.77 95.86 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.974 1.261 . . . . 0.0 112.645 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 tpt180 -64.73 -26.5 68.39 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -84.42 -31.48 24.62 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.609 168.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -78.93 -166.05 0.84 Allowed 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.348 -0.845 . . . . 0.0 109.09 169.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.98 -126.42 13.66 Favored Glycine 0 N--CA 1.469 0.868 0 C-N-CA 119.877 -1.154 . . . . 0.0 112.371 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -157.92 -81.66 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.942 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -157.79 -53.89 0.07 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.37 -173.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.78 -109.29 3.03 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 120.203 -0.999 . . . . 0.0 111.651 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -93.18 30.88 1.55 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -86.72 -16.11 37.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.338 -0.852 . . . . 0.0 112.367 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -69.85 -15.03 63.03 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -33.01 -52.78 0.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -172.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 48.3 mtm105 -64.18 -61.78 2.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.678 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 21.0 t -40.97 -47.77 3.07 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.472 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 46.6 t -76.26 -36.81 58.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -71.53 -47.39 55.52 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.598 -0.689 . . . . 0.0 111.406 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -71.16 -43.96 66.48 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.794 -0.566 . . . . 0.0 111.977 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -98.72 86.13 3.47 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 N--CA 1.469 0.492 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.76 -177.71 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.0 tp . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -90.64 77.58 6.35 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.392 0.615 . . . . 0.0 109.574 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -28.82 112.73 0.07 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 -171.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -117.99 83.73 2.05 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.893 0.854 . . . . 0.0 109.504 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.87 169.2 18.4 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.746 0.784 . . . . 0.0 111.13 175.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -71.86 105.82 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 122.11 0.957 . . . . 0.0 110.302 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.87 -80.39 0.29 Allowed Glycine 0 N--CA 1.468 0.798 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -173.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -33.41 153.66 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.868 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 -175.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -44.21 141.38 4.88 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.812 2.341 . . . . 0.0 116.592 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.6 t -86.97 177.8 7.13 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.256 -176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.0 tp -54.49 -40.37 68.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -82.06 81.65 7.93 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.463 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.5 p 168.38 138.96 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 166.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -65.33 -20.74 66.53 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -178.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.3 -33.57 73.79 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.326 -0.859 . . . . 0.0 113.039 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -70.96 -40.04 72.2 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.725 173.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.09 -35.87 74.15 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 177.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.72 66.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.624 -0.672 . . . . 0.0 112.684 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.2 p -70.91 -36.59 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 O-C-N 121.671 -0.643 . . . . 0.0 112.715 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.0 p -67.93 -37.99 82.33 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.608 -0.683 . . . . 0.0 112.618 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -59.77 -35.97 75.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -65.45 -45.59 83.18 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.705 -0.622 . . . . 0.0 112.148 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.1 m -72.47 -38.13 68.3 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.659 -0.651 . . . . 0.0 112.582 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -65.91 -26.86 67.8 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.63 -39.03 49.33 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -71.91 -57.66 4.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.743 170.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.3 74.87 1.25 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 120.171 -1.014 . . . . 0.0 112.079 173.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -102.56 148.14 25.92 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.631 0.729 . . . . 0.0 110.046 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.8 mt -126.75 86.1 2.47 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 174.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 157.78 -83.42 0.14 Allowed Glycine 0 CA--C 1.526 0.763 0 C-N-CA 119.759 -1.21 . . . . 0.0 111.621 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 28.2 t70 -142.92 129.73 20.46 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 32.7 t70 172.87 -56.89 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 169.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -32.93 -49.53 0.24 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -33.86 -58.05 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -66.52 -60.2 2.95 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.52 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -36.72 -46.31 0.59 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 m -73.54 -45.71 51.98 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -67.25 -29.9 69.65 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.09 -50.24 62.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.43 -0.794 . . . . 0.0 111.646 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -87.46 72.64 9.67 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.009 0.909 . . . . 0.0 109.028 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.469 0.502 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -175.367 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -115.05 77.15 1.04 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.126 -174.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -26.37 120.79 0.08 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.882 2.179 . . . . 0.0 116.882 -172.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -94.13 79.67 4.04 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.862 0.839 . . . . 0.0 109.494 178.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -87.44 151.44 23.05 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.651 0.739 . . . . 0.0 110.826 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.72 110.32 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.884 0.85 . . . . 0.0 109.063 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.94 -48.36 0.95 Allowed Glycine 0 CA--C 1.528 0.863 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.169 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.606 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 16.2 t -64.87 150.13 95.31 Favored Pre-proline 0 CA--C 1.542 0.641 0 O-C-N 122.213 -0.581 . . . . 0.0 111.65 -175.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.606 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 92.5 Cg_exo -57.99 174.43 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 121.926 1.751 . . . . 0.0 115.696 -174.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -63.12 167.26 5.12 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.986 0.898 . . . . 0.0 112.849 -174.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 74.6 mt -52.96 -53.65 46.56 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -173.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -97.61 90.49 5.03 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.847 0.832 . . . . 0.0 109.063 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -148.38 176.49 10.23 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.942 0.877 . . . . 0.0 109.956 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -68.15 -45.34 73.81 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.465 -0.772 . . . . 0.0 112.413 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.61 -62.12 1.51 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.927 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -40.57 -48.72 2.9 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.581 1.696 . . . . 0.0 115.581 -172.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.71 -45.71 77.82 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.48 71.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.707 -0.62 . . . . 0.0 112.649 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.1 m -68.5 -35.47 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -70.04 -33.54 72.1 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.735 -0.603 . . . . 0.0 112.578 176.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -65.13 -38.61 91.2 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.635 -0.666 . . . . 0.0 112.241 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.99 -44.69 97.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.921 -0.487 . . . . 0.0 112.161 174.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.0 m -72.67 -32.9 66.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.2 tpt85 -69.51 -37.54 77.21 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.68 -32.83 74.44 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -142.87 81.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.93 0.871 . . . . 0.0 109.028 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.28 36.16 0.02 OUTLIER Glycine 0 CA--C 1.529 0.96 0 C-N-CA 119.854 -1.165 . . . . 0.0 113.138 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -83.55 94.52 8.08 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.83 0.824 . . . . 0.0 109.906 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.09 -44.28 0.57 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.866 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.6 44.92 1.48 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.45 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -170.74 -46.59 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -29.81 70.85 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -59.63 -33.34 71.38 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -65.44 -54.77 23.66 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.593 -0.692 . . . . 0.0 111.419 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -71.12 -32.73 69.37 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.5 t -67.05 -44.73 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -176.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 m -66.18 -37.57 85.93 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -53.32 -52.38 59.34 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.843 0.747 . . . . 0.0 112.263 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -29.69 -54.7 0.16 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -99.51 -34.87 10.08 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.9 t . . . . . 0 N--CA 1.471 0.606 0 O-C-N 121.354 -0.841 . . . . 0.0 113.227 -175.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -104.81 156.4 18.04 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.93 0.871 . . . . 0.0 110.355 -174.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.3 t -85.46 131.82 34.32 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.38 0.609 . . . . 0.0 111.145 -176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -133.8 78.01 1.74 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.12 -160.12 0.64 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.435 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.27 100.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 169.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.08 -53.98 0.5 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.796 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.0 t -74.07 167.19 37.9 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 122.456 -0.437 . . . . 0.0 109.988 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.678 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 71.5 Cg_exo -66.12 175.23 4.98 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.402 1.401 . . . . 0.0 114.739 -169.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.0 m -67.98 142.78 55.86 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.46 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.71 -40.4 72.37 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.8 60.28 5.83 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.762 0.792 . . . . 0.0 110.728 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.9 p -156.53 143.62 18.86 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.08 -23.99 66.84 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -38.31 90.62 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 112.487 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -67.35 -39.94 85.8 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.747 -0.596 . . . . 0.0 112.025 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.81 -37.74 69.04 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.73 -43.98 87.37 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.472 -0.768 . . . . 0.0 112.693 176.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' SG ' ' A' ' 11' ' ' CYS . 97.4 t -72.89 -47.1 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.756 -0.59 . . . . 0.0 111.629 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 90.9 p -67.85 -24.66 65.29 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -83.93 -22.98 31.34 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 171.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -83.44 -32.11 26.24 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 118.335 -1.346 . . . . 0.0 112.117 168.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -66.34 -41.39 89.65 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 120.968 -1.083 . . . . 0.0 111.789 170.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.8 tpt85 -35.02 -52.53 0.56 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -35.12 -57.87 0.56 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -171.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -90.24 106.11 18.27 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -175.74 92.16 0.09 OUTLIER Glycine 0 N--CA 1.465 0.608 0 C-N-CA 119.181 -1.485 . . . . 0.0 111.57 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -86.28 -61.6 1.71 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.97 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.5 mt -125.02 -62.54 1.22 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.85 80.48 0.08 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -135.99 -53.58 0.75 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.526 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.15 -56.46 6.8 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 120.326 -0.549 . . . . 0.0 111.399 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -29.54 -53.97 0.14 Allowed 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -172.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -39.55 -55.88 1.75 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -172.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.9 -56.77 10.07 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.189 -0.605 . . . . 0.0 111.057 177.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -38.23 -51.62 1.47 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.72 -34.87 52.53 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -77.57 -28.5 51.77 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -178.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -96.81 -94.36 0.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 119.351 -0.94 . . . . 0.0 108.809 170.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -28.78 -64.21 0.1 Allowed 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 42.6 t . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.6 tp . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.772 0.796 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -120.37 106.44 11.85 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -175.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.4 m -12.79 111.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -137.81 76.42 1.58 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.75 -168.3 1.55 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.763 0.792 . . . . 0.0 111.252 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -74.93 101.5 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.768 0.794 . . . . 0.0 108.971 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.72 40.41 5.31 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.069 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 19.9 t -117.38 148.73 43.3 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.613 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 84.2 Cg_exo -55.52 170.93 0.73 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.053 1.835 . . . . 0.0 114.732 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -65.71 161.72 20.09 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.523 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 tp -57.33 -59.21 5.47 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -89.62 79.92 6.74 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.386 1.089 . . . . 0.0 110.636 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.7 p -151.96 154.77 36.72 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -60.0 -39.59 86.29 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -41.43 89.92 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -66.15 -48.68 69.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.64 -33.08 72.27 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.273 -0.892 . . . . 0.0 113.148 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -50.31 64.85 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.419 -0.801 . . . . 0.0 112.291 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -74.08 -33.88 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.0 m -69.56 -39.82 77.16 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -65.96 -29.88 70.35 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.57 -47.21 82.46 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.649 -0.657 . . . . 0.0 111.974 176.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.41 -59.96 2.65 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.991 174.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -35.21 -49.23 0.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -58.66 -55.72 31.43 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -170.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -90.04 90.26 8.06 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.174 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 142.67 -35.06 1.75 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.512 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -14.72 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 -169.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.4 mt -143.09 -70.3 0.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.57 -81.01 0.08 OUTLIER Glycine 0 N--CA 1.467 0.722 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -177.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -87.01 83.22 7.54 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -158.15 -29.14 0.08 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.809 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -99.67 52.71 0.93 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.517 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -80.1 -49.54 11.6 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.023 172.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -75.71 -39.32 57.56 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.875 -0.516 . . . . 0.0 112.347 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.2 t -61.96 -43.54 98.63 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.532 -0.73 . . . . 0.0 112.914 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.4 m -68.23 -48.44 65.12 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 120.19 -0.604 . . . . 0.0 112.338 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.15 -41.62 73.6 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.05 -24.55 63.27 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -97.72 -96.62 0.21 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 168.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.613 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.8 t . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 -170.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -79.8 120.51 24.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.557 0.694 . . . . 0.0 110.614 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.437 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 30.1 p -81.79 111.68 18.24 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.965 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -92.65 73.1 5.04 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.894 0.854 . . . . 0.0 109.513 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.54 167.02 12.53 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.853 0.835 . . . . 0.0 110.494 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.1 -38.22 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.64 2.67 73.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 120.035 -1.078 . . . . 0.0 114.925 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.558 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.5 t -94.54 155.22 39.81 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 118.649 1.224 . . . . 0.0 110.424 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.558 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 50.4 Cg_exo -67.21 176.47 4.65 Favored 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 121.542 1.494 . . . . 0.0 113.871 -173.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.7 t -72.59 158.47 35.61 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.882 0.849 . . . . 0.0 111.356 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -61.11 -42.55 98.74 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -70.21 -26.85 64.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -175.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -74.51 148.98 40.46 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.866 0.841 . . . . 0.0 111.329 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.03 -19.49 65.7 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -176.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.88 91.3 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.375 -0.828 . . . . 0.0 112.712 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -68.86 -36.91 78.7 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.658 -0.651 . . . . 0.0 112.002 174.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -62.41 -42.25 99.3 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.679 -0.638 . . . . 0.0 112.226 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.33 -46.11 71.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.405 HG11 ' SG ' ' A' ' 44' ' ' CYS . 7.4 p -68.66 -29.56 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.8 p -64.17 -29.85 70.95 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.8 tptp -66.2 -41.88 89.56 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.578 -0.701 . . . . 0.0 111.761 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -64.23 -44.88 90.49 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 112.05 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.27 -31.13 72.12 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.6 tpt180 -63.18 -41.4 99.21 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.536 -0.727 . . . . 0.0 112.516 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -64.86 -36.85 85.67 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.597 -0.689 . . . . 0.0 112.416 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -81.83 126.15 31.53 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.772 0.796 . . . . 0.0 110.444 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.22 -125.76 8.23 Favored Glycine 0 N--CA 1.467 0.74 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.327 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -163.27 -67.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.402 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.49 -52.43 0.71 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.366 -0.533 . . . . 0.0 110.873 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.49 62.42 0.43 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.909 -1.139 . . . . 0.0 111.644 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -156.9 36.13 0.3 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.654 0.74 . . . . 0.0 111.893 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -161.05 -54.36 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -34.5 -42.32 0.14 Allowed 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -62.75 -57.83 9.58 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.583 -0.447 . . . . 0.0 112.02 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -63.04 -48.12 80.09 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.303 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.3 t -37.78 -59.52 0.81 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.36 -29.69 53.48 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.45 -27.28 69.17 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.939 -1.101 . . . . 0.0 113.811 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -97.08 -53.51 3.47 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.622 169.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -77.04 -45.38 27.34 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.488 -0.758 . . . . 0.0 112.935 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.545 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.0 t . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.938 0.875 . . . . 0.0 111.163 -177.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 43.3 tp . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -87.14 179.39 6.66 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.546 1.165 . . . . 0.0 112.025 -169.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.4 t -113.74 122.97 48.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.049 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -142.94 78.02 1.59 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 122.026 0.917 . . . . 0.0 108.56 174.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -87.0 -168.35 2.21 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.596 0.712 . . . . 0.0 110.848 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.9 mt -76.5 97.03 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.82 0.819 . . . . 0.0 109.038 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.57 47.74 3.4 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.734 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.578 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.2 t -117.3 150.68 46.8 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.578 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.2 Cg_exo -60.94 175.11 1.43 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 121.708 1.605 . . . . 0.0 114.305 -177.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.7 p -72.39 150.33 43.51 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.665 0.745 . . . . 0.0 110.862 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -69.02 -12.95 62.15 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -77.25 -33.94 55.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.407 -0.808 . . . . 0.0 111.889 174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.2 p -75.84 153.91 36.5 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.022 0.915 . . . . 0.0 111.44 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -67.57 -27.43 66.92 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -47.11 86.96 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.485 -0.759 . . . . 0.0 113.018 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -70.75 -32.53 69.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.07 -34.54 76.48 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.522 -0.736 . . . . 0.0 112.619 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -35.09 79.98 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.531 -0.731 . . . . 0.0 112.887 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.15 -49.15 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 121.748 -0.595 . . . . 0.0 111.023 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -65.29 -29.8 70.6 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -67.29 -27.92 67.58 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 178.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -86.77 -37.83 17.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 118.827 -1.149 . . . . 0.0 112.496 168.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.1 m -66.63 -61.05 2.18 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.06 -1.025 . . . . 0.0 112.125 -178.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -36.89 -45.72 0.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.8 -29.55 64.97 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -176.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -64.57 -53.99 39.2 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.531 -0.731 . . . . 0.0 111.186 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.57 97.6 1.4 Allowed Glycine 0 N--CA 1.467 0.726 0 C-N-CA 119.966 -1.111 . . . . 0.0 112.094 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -145.16 101.02 3.56 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.73 157.27 18.57 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.908 0.861 . . . . 0.0 110.201 -175.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.71 -74.81 1.31 Allowed Glycine 0 N--CA 1.468 0.806 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -90.02 103.86 16.48 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -65.02 114.76 4.8 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -22.05 81.93 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 -169.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -88.17 -12.2 44.62 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -170.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.01 -62.23 1.62 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 118.323 -1.351 . . . . 0.0 108.188 167.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.7 t -43.4 -42.01 4.47 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 48.8 t -64.63 -51.35 63.11 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -68.98 -58.18 4.46 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.581 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -31.69 -67.92 0.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -91.51 52.73 2.12 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.277 0.561 . . . . 0.0 111.579 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.457 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.3 t . . . . . 0 N--CA 1.469 0.52 0 O-C-N 121.28 -0.888 . . . . 0.0 110.241 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.9 tt . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -98.4 172.17 7.71 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.512 0.673 . . . . 0.0 109.726 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 4.3 t -115.04 114.61 25.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.161 169.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -100.59 75.63 1.76 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.68 0.752 . . . . 0.0 110.44 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -107.21 153.8 22.16 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.575 0.702 . . . . 0.0 109.509 172.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.2 tp -68.08 -39.95 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.63 31.69 6.0 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.499 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.716 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 2.2 t -117.61 152.21 49.38 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.716 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 49.9 Cg_endo -71.19 -175.48 1.52 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.592 1.528 . . . . 0.0 112.882 -174.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -58.83 149.03 27.83 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.767 0.794 . . . . 0.0 112.563 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.5 mt -59.32 -47.02 86.97 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.643 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -85.04 96.06 9.29 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.393 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 p 169.82 162.32 0.06 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 166.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -61.68 -32.85 73.06 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -172.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.13 81.77 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.546 -0.722 . . . . 0.0 112.565 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -67.78 -40.22 83.99 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.654 -0.654 . . . . 0.0 112.442 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.23 -38.97 88.55 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.92 94.56 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.1 t -68.97 -45.42 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 O-C-N 121.771 -0.581 . . . . 0.0 111.377 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.3 p -63.02 -41.59 99.59 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -73.75 -30.93 63.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.57 -51.11 46.23 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.742 -0.599 . . . . 0.0 111.734 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.1 t -76.73 -28.62 55.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.718 -0.793 . . . . 0.0 113.021 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.52 -41.13 84.78 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.621 -0.674 . . . . 0.0 112.271 170.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -63.11 -36.28 83.07 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.74 -0.6 . . . . 0.0 112.523 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -69.87 -54.61 12.67 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.791 -0.568 . . . . 0.0 111.312 176.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 31' ' ' LYS . . . -94.81 -109.36 2.24 Favored Glycine 0 N--CA 1.468 0.807 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 57.6 tptt 169.52 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 167.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.5 mt -124.12 127.4 47.74 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.11 -147.91 14.08 Favored Glycine 0 CA--C 1.526 0.753 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.607 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.7 -35.38 65.15 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.229 -0.571 . . . . 0.0 112.513 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -18.37 -56.94 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.534 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 82.1 m-85 -58.86 -25.48 63.33 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -169.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -66.85 -57.58 6.72 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.121 -0.987 . . . . 0.0 111.4 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -68.99 -60.02 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.225 175.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.9 t -48.6 -29.38 4.23 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -172.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.8 m -87.08 -45.74 10.43 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 119.029 -1.069 . . . . 0.0 112.683 170.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.37 -41.31 51.66 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -178.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.44 -56.3 4.65 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.63 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -91.78 67.82 5.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.392 -0.818 . . . . 0.0 111.649 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 46.1 t . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 122.001 0.905 . . . . 0.0 109.968 175.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tt . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -80.57 94.2 6.23 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.772 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.2 t -25.32 120.33 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 117.09 2.255 . . . . 0.0 117.09 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -88.48 79.35 7.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.921 0.867 . . . . 0.0 109.749 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.11 162.09 13.69 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 122.034 0.921 . . . . 0.0 111.038 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -76.2 -66.85 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.093 -176.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.84 60.56 0.46 Allowed Glycine 0 N--CA 1.469 0.882 0 C-N-CA 120.151 -1.023 . . . . 0.0 111.872 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.656 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 13.9 t -117.46 154.77 50.61 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.656 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.9 Cg_exo -58.86 -176.16 0.09 OUTLIER 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.969 1.779 . . . . 0.0 115.464 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.2 m -57.77 144.63 37.68 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.658 0.742 . . . . 0.0 111.636 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.04 -56.5 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.408 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -91.36 68.83 5.91 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.301 1.048 . . . . 0.0 110.71 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.6 p -139.59 160.72 39.21 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.521 0.677 . . . . 0.0 109.254 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.31 -31.42 71.26 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.25 -54.63 9.02 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.58 -0.7 . . . . 0.0 112.004 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -68.95 -29.86 68.18 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -61.86 -39.46 91.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.414 -0.804 . . . . 0.0 112.216 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.19 -36.0 81.94 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 173.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.4 t -63.01 -48.68 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.821 -0.549 . . . . 0.0 111.132 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.8 m -64.79 -29.06 70.02 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 177.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -61.84 -54.2 45.43 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.7 -0.625 . . . . 0.0 112.112 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -73.5 -63.88 1.1 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.924 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.5 m -38.84 -43.08 0.9 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 116.925 2.194 . . . . 0.0 116.925 -174.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -48.1 -29.01 3.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -57.16 -31.89 65.85 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -177.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -132.88 121.38 22.8 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.603 -0.686 . . . . 0.0 109.591 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.24 22.09 2.18 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 120.626 -0.797 . . . . 0.0 114.612 175.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -17.72 -72.35 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -172.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.12 165.34 28.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.865 0.84 . . . . 0.0 110.62 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.44 -80.04 1.29 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 120.182 -1.009 . . . . 0.0 110.674 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.11 86.63 4.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.81 118.3 10.13 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -29.17 84.37 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -94.76 -15.05 24.14 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.681 -1.145 . . . . 0.0 114.073 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -87.23 -33.4 19.32 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 118.833 -1.147 . . . . 0.0 112.465 169.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.82 -47.25 85.45 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.377 -0.827 . . . . 0.0 112.606 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.8 m -77.45 -43.6 31.84 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -177.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -68.12 -39.77 82.66 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.586 -0.696 . . . . 0.0 112.774 -177.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -71.77 -45.83 60.34 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.662 -0.649 . . . . 0.0 112.352 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -79.47 -77.51 0.18 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.434 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.527 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 49.4 t . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -170.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.2 tp . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -78.66 156.64 28.91 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.07 0.938 . . . . 0.0 110.804 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.442 ' SG ' HG12 ' A' ' 22' ' ' VAL . 4.7 m -67.79 139.64 56.62 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.018 0.913 . . . . 0.0 111.77 178.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -149.4 77.97 1.36 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 173.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.14 -179.35 5.06 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.8 0.81 . . . . 0.0 110.908 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.2 tt -65.06 -38.05 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.38 46.96 1.04 Allowed Glycine 0 CA--C 1.529 0.946 0 C-N-CA 120.239 -0.981 . . . . 0.0 112.003 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.536 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 48.5 t -117.27 145.55 36.22 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 169.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.536 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 91.3 Cg_exo -50.19 150.5 10.56 Favored 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.264 1.976 . . . . 0.0 114.815 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.7 t -78.4 -178.5 5.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.896 0.855 . . . . 0.0 111.859 -173.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.8 -42.67 89.62 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -85.76 70.21 10.67 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.887 0.851 . . . . 0.0 110.216 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -159.6 141.11 12.94 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.7 -34.62 77.53 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.74 -38.54 89.4 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -67.11 -29.13 68.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.95 -38.77 89.74 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.246 -0.909 . . . . 0.0 111.887 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.77 72.63 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.442 HG12 ' SG ' ' A' ' 6' ' ' CYS . 65.0 t -69.69 -47.08 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.603 -0.686 . . . . 0.0 110.985 175.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.7 t -63.45 -34.07 76.94 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.281 -0.568 . . . . 0.0 112.422 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.92 -36.64 70.43 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.007 -1.058 . . . . 0.0 112.377 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -76.68 -55.42 5.52 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.8 -0.562 . . . . 0.0 111.756 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.2 m -77.82 -52.21 9.27 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -60.41 -26.68 66.88 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -49.0 -29.92 5.43 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -63.88 -60.24 3.52 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.383 -0.823 . . . . 0.0 111.083 173.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.76 92.18 2.23 Favored Glycine 0 N--CA 1.468 0.81 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.996 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -157.41 125.09 5.33 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.611 ' H ' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -81.77 166.74 19.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.978 0.894 . . . . 0.0 112.28 -175.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.77 -113.47 4.73 Favored Glycine 0 N--CA 1.466 0.699 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -142.57 47.6 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.71 0.766 . . . . 0.0 110.707 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -93.19 4.7 53.54 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -99.98 -8.44 23.9 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.349 -0.941 . . . . 0.0 113.165 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -35.97 -55.06 0.76 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.73 -38.33 70.48 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -63.61 -38.87 92.76 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.589 -0.694 . . . . 0.0 112.796 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -64.48 -47.42 79.02 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.37 -30.55 66.28 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.44 -62.04 1.7 Allowed 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.468 -0.77 . . . . 0.0 110.344 177.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 44' ' ' CYS . 40.6 mt-30 -85.58 97.27 9.98 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.506 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.2 t . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 169.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.9 tp . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 122.276 1.036 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.577 ' HB3' HD21 ' A' ' 19' ' ' ASN . 76.1 m-85 -105.21 95.09 5.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.257 -174.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -8.71 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -125.59 76.45 1.57 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.861 -172.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.94 -172.99 2.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.774 169.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.92 102.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 122.192 0.996 . . . . 0.0 109.85 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.39 -82.98 0.25 Allowed Glycine 0 N--CA 1.467 0.748 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.89 145.21 0.07 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -174.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.552 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 74.8 Cg_exo -58.18 162.96 10.7 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 121.927 1.751 . . . . 0.0 114.784 -174.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.5 t -67.02 165.52 15.53 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.636 0.731 . . . . 0.0 111.526 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.08 -54.64 44.7 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.867 -0.52 . . . . 0.0 112.323 -174.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -87.83 79.47 8.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.911 0.862 . . . . 0.0 110.409 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.1 p -153.28 149.88 28.37 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.38 -40.2 89.98 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.48 77.95 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.577 HD21 ' HB3' ' A' ' 5' ' ' TYR . 26.0 t30 -64.28 -33.64 76.29 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.9 -41.72 96.64 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 111.908 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.93 92.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 175.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.436 HG21 ' SG ' ' A' ' 44' ' ' CYS . 67.5 t -66.41 -52.24 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 O-C-N 121.753 -0.592 . . . . 0.0 111.431 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.8 t -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -55.21 -42.12 72.92 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.148 -0.97 . . . . 0.0 112.528 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -76.19 -54.06 7.36 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.807 -0.558 . . . . 0.0 112.137 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.87 -38.42 45.98 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -173.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -67.93 -27.92 67.04 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -86.69 -61.16 1.8 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 118.884 -1.127 . . . . 0.0 111.443 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -92.2 118.79 31.2 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 0.0 109.937 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.14 36.8 5.6 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.359 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -92.91 70.69 4.68 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.757 -0.849 . . . . 0.0 109.311 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.8 mt -138.39 44.7 2.1 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.134 -176.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 80.44 -84.49 1.37 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.146 -1.026 . . . . 0.0 112.838 174.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.65 87.96 7.32 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 122.202 1.001 . . . . 0.0 109.867 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -166.32 -38.09 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.04 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.536 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 97.6 m-85 -72.52 -26.83 61.91 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -65.64 -49.55 68.28 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.167 -0.958 . . . . 0.0 111.356 177.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -68.19 -32.44 72.68 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.7 t -69.45 -47.1 65.1 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.386 -0.821 . . . . 0.0 112.585 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.536 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 5.6 m -71.69 -41.09 69.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.425 -0.797 . . . . 0.0 112.254 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -78.91 -29.5 44.25 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -99.04 -60.49 1.52 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.291 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -69.97 -71.04 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.498 -172.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.552 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 50.3 t . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 -172.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 tt . . . . . 0 N--CA 1.468 0.445 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -135.52 109.09 7.94 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.9 m -13.06 118.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -146.39 83.73 1.62 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 170.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.28 -153.76 0.16 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.519 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.7 mm -71.83 -58.88 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.275 -0.89 . . . . 0.0 110.782 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -76.86 -55.9 4.31 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.836 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.605 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.68 139.28 0.16 Allowed Pre-proline 0 N--CA 1.477 0.881 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -170.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.618 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 39.6 Cg_endo -67.43 176.95 4.31 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 121.738 1.625 . . . . 0.0 113.431 -173.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.3 p -74.12 153.29 39.64 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.656 0.741 . . . . 0.0 111.265 -175.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.763 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -71.14 -3.64 21.06 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.214 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -97.31 -19.08 18.77 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.446 -0.784 . . . . 0.0 112.915 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -75.84 146.69 39.67 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.205 -0.934 . . . . 0.0 110.932 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.02 -41.46 71.38 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -172.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.01 76.91 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -71.25 -35.33 71.37 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.75 -30.44 70.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.246 -0.909 . . . . 0.0 112.893 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.09 33.1 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.26 -0.9 . . . . 0.0 112.051 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.0 p -67.64 -39.67 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.6 p -75.88 -35.55 59.83 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -176.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -66.48 -29.79 69.98 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.81 -52.29 66.08 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.469 -0.769 . . . . 0.0 112.223 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.9 m -76.94 -31.75 56.84 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -66.36 -43.67 85.35 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.994 -1.066 . . . . 0.0 112.257 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -67.62 -43.88 79.36 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.66 -0.65 . . . . 0.0 112.149 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -120.95 100.15 6.91 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -53.97 0.31 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 119.89 -1.148 . . . . 0.0 111.309 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -15.04 100.17 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.6 tp -160.86 -62.27 0.06 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.918 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.37 -68.46 0.29 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.127 -1.189 . . . . 0.0 110.127 -174.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 19.4 m-20 -85.49 85.12 7.45 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 38.8 t70 172.86 11.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.2 168.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.481 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 95.9 m-85 -101.3 -29.79 11.86 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.581 -1.324 . . . . 0.0 112.295 169.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -70.23 -50.04 43.93 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.149 -0.969 . . . . 0.0 110.918 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.492 ' HE ' ' HA ' ' A' ' 35' ' ' ASP . 38.3 ptt180 -67.68 -39.65 84.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.4 t -65.46 -43.89 88.91 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.485 -0.76 . . . . 0.0 113.051 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.481 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 73.5 m -63.69 -62.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.853 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -42.33 -62.65 0.91 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -174.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -36.95 -62.15 0.51 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -173.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -91.74 -12.15 34.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.618 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.9 t . . . . . 0 N--CA 1.468 0.448 0 O-C-N 121.136 -0.977 . . . . 0.0 110.522 -174.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.8 tp . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -94.37 161.43 14.24 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.858 0.837 . . . . 0.0 110.215 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 t -82.5 85.29 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -124.8 77.26 1.59 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.014 -0.675 . . . . 0.0 110.199 -171.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.421 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . . . -92.08 -106.16 0.11 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.629 -0.829 . . . . 0.0 109.451 173.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.5 mm -90.41 -69.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -171.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.78 -50.98 4.2 Favored Glycine 0 N--CA 1.47 0.923 0 C-N-CA 120.126 -1.035 . . . . 0.0 113.71 -172.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 7.3 t -20.85 133.87 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -170.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.728 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 71.2 Cg_exo -54.43 170.98 0.46 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.329 2.019 . . . . 0.0 114.941 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -61.68 164.81 5.67 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 122.123 0.963 . . . . 0.0 112.698 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -171.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -99.61 52.05 0.93 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.781 -174.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.2 p -108.21 166.36 10.8 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.778 0.799 . . . . 0.0 110.178 176.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.32 -44.62 78.71 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.423 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.17 81.18 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -65.46 -29.8 70.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.7 -41.46 90.8 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.407 -0.808 . . . . 0.0 113.124 -178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.03 69.74 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.562 -0.711 . . . . 0.0 112.817 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HB2' ' A' ' 44' ' ' CYS . 14.8 p -70.01 -39.79 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.5 p -66.36 -21.95 66.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -82.48 -23.34 34.76 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 171.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -85.64 -49.73 7.77 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.47 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.94 -28.34 64.41 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -67.44 -26.05 66.21 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.954 -1.091 . . . . 0.0 113.279 171.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -84.08 -44.22 14.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 118.852 -1.139 . . . . 0.0 111.117 168.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -85.21 71.76 10.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.222 -0.924 . . . . 0.0 109.189 171.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -132.64 125.1 4.04 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -83.98 -101.48 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.022 -0.671 . . . . 0.0 109.432 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.7 mt -140.4 76.19 1.54 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.77 -44.73 3.39 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 119.923 -1.132 . . . . 0.0 113.843 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -68.18 -69.03 0.35 Allowed 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.985 -0.715 . . . . 0.0 111.914 -174.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -19.47 -67.1 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 -173.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -35.32 -47.37 0.41 Allowed 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -174.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -35.39 -53.65 0.65 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -175.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -66.4 -61.21 2.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.444 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.8 t -37.07 -49.13 0.84 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 3.1 m -72.49 -35.63 68.21 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -175.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -72.35 -48.55 41.03 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.294 -0.879 . . . . 0.0 111.323 175.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -81.44 -96.27 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -34.14 -53.2 0.48 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -173.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.728 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 43.5 t . . . . . 0 N--CA 1.468 0.454 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.5 tp . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 117.734 2.494 . . . . 0.0 117.734 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -99.36 139.24 35.31 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.962 175.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.8 t -83.92 93.72 8.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.712 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -97.76 78.51 2.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.833 0.825 . . . . 0.0 109.234 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 155.54 32.28 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.636 0.732 . . . . 0.0 110.762 177.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.59 110.63 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 121.871 0.843 . . . . 0.0 109.9 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.3 -42.39 1.82 Allowed Glycine 0 CA--C 1.53 1.013 0 C-N-CA 120.237 -0.982 . . . . 0.0 112.001 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.2 m -80.74 169.47 19.39 Favored Pre-proline 0 CA--C 1.542 0.645 0 O-C-N 122.096 -0.649 . . . . 0.0 110.71 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -58.63 152.84 53.03 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 121.877 1.718 . . . . 0.0 115.44 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -76.68 164.43 25.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.556 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.1 tp -50.29 -50.4 50.56 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -173.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -90.84 36.75 0.91 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.737 -0.785 . . . . 0.0 112.834 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.6 p -109.98 151.25 27.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.954 0.883 . . . . 0.0 110.451 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.33 -33.54 75.74 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.64 -55.68 24.75 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.718 -0.613 . . . . 0.0 111.215 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 22' ' ' VAL . 20.5 t-20 -37.92 -40.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -177.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.9 mp -54.13 -38.41 65.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.46 -43.42 66.68 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 19' ' ' ASN . 8.1 p -65.23 -22.75 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 176.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -82.42 -55.19 4.65 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 118.224 -1.39 . . . . 0.0 109.493 167.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -36.14 -54.98 0.79 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -175.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.93 -46.42 24.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -177.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.4 m -63.07 -50.24 71.37 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.548 -0.72 . . . . 0.0 112.385 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -55.85 -32.68 63.84 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.8 -29.31 68.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 175.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -76.04 95.33 3.59 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.67 0.748 . . . . 0.0 110.043 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.41 -130.61 9.95 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.468 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -163.76 -56.19 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.331 -0.548 . . . . 0.0 109.964 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.2 tp -145.38 111.75 5.74 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.75 -167.08 37.23 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.719 -1.229 . . . . 0.0 111.846 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -89.49 15.37 9.43 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.15 -27.93 57.18 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.232 -0.918 . . . . 0.0 112.614 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.451 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 22.6 m-85 -71.6 -24.74 61.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -172.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.34 -49.3 77.51 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.416 -0.803 . . . . 0.0 112.072 -177.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -63.45 -39.2 93.85 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.675 -0.641 . . . . 0.0 112.455 176.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.0 t -61.47 -44.95 96.18 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 4.4 m -73.69 -29.21 62.15 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.95 -26.85 66.32 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 172.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -92.39 -98.91 0.13 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 167.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -36.57 112.85 0.2 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 52.7 t . . . . . 0 N--CA 1.47 0.567 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.268 -169.681 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 44.2 tp . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -84.18 85.86 7.3 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.809 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -26.14 121.18 0.07 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.578 2.066 . . . . 0.0 116.578 -175.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -89.36 78.97 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.749 0.785 . . . . 0.0 109.852 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.83 154.51 35.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.69 0.757 . . . . 0.0 110.144 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.4 mm -81.03 99.86 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-O 121.667 0.746 . . . . 0.0 109.937 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.81 -82.65 0.15 Allowed Glycine 0 N--CA 1.467 0.726 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.8 t -35.19 150.75 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -171.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 87.9 Cg_exo -55.87 -173.29 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.4 2.067 . . . . 0.0 116.541 -174.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.7 m -50.91 146.33 6.17 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.436 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.6 tp -55.8 -51.91 65.83 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -100.08 81.9 2.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.694 0.759 . . . . 0.0 109.282 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -143.67 171.27 14.42 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.842 0.829 . . . . 0.0 110.341 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -67.58 -43.0 81.65 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.761 -0.587 . . . . 0.0 112.36 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.57 -45.21 80.05 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.733 -0.604 . . . . 0.0 112.462 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.7 -31.53 72.59 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.3 tp -64.32 -41.7 96.68 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.297 -0.877 . . . . 0.0 112.297 175.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.23 76.46 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.636 -0.665 . . . . 0.0 112.785 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.542 HG11 ' SG ' ' A' ' 11' ' ' CYS . 14.6 p -62.72 -41.43 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.691 -0.631 . . . . 0.0 112.396 178.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.9 p -66.43 -29.93 70.18 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -67.06 -28.61 68.34 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -86.71 -63.21 1.35 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 118.293 -1.363 . . . . 0.0 109.76 167.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.433 ' SG ' HG22 ' A' ' 22' ' ' VAL . 73.1 m -37.25 -47.84 0.83 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.378 1.992 . . . . 0.0 116.378 -174.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -51.76 -29.16 17.64 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -57.31 -29.31 63.82 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -71.34 176.19 4.8 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.96 0.886 . . . . 0.0 110.662 175.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.4 120.02 17.78 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 120.392 -0.909 . . . . 0.0 113.298 -174.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 ttmt -84.52 95.69 8.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.698 0.761 . . . . 0.0 110.084 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -113.1 -45.27 3.18 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.95 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.36 -89.12 0.08 OUTLIER Glycine 0 CA--C 1.523 0.575 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -101.21 44.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.676 0.751 . . . . 0.0 110.376 172.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -96.39 3.63 52.75 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.606 -0.684 . . . . 0.0 112.54 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -99.68 -1.65 37.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.695 169.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -34.05 -54.3 0.48 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -68.29 -57.46 5.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.02 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 23.0 t -40.02 -38.46 0.72 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 117.571 2.434 . . . . 0.0 117.571 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.3 m -90.18 -24.63 20.97 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 172.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -86.22 -25.71 25.46 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -96.58 -46.89 6.15 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.149 -0.969 . . . . 0.0 112.139 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -99.18 71.03 1.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 118.993 -1.083 . . . . 0.0 110.719 170.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.617 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.7 t . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 166.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 121.584 0.707 . . . . 0.0 109.276 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.15 147.87 26.4 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.3 t -85.22 107.56 17.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.058 -173.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -99.92 80.65 2.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.696 0.76 . . . . 0.0 109.447 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.59 -149.28 0.25 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.603 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.51 111.6 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 169.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.84 38.0 6.65 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.414 -0.898 . . . . 0.0 113.337 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.648 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.6 t -117.93 153.22 50.96 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.648 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -56.49 175.75 0.25 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.093 1.862 . . . . 0.0 114.852 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 75.3 p -59.93 149.21 32.43 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.592 0.71 . . . . 0.0 111.461 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.84 -47.03 77.98 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -171.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.16 0.1 46.82 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -177.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -73.12 161.12 30.99 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.902 -1.124 . . . . 0.0 111.626 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -67.63 -33.16 74.42 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.08 -43.57 86.96 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.591 -0.693 . . . . 0.0 112.53 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -66.96 -36.55 82.45 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.644 -0.66 . . . . 0.0 112.313 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.72 -42.63 99.75 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.67 -0.644 . . . . 0.0 111.701 175.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.32 -43.18 99.41 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.79 -37.49 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.55 -0.719 . . . . 0.0 112.469 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -64.01 -35.11 79.65 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.531 -0.731 . . . . 0.0 112.096 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -57.36 -40.56 78.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -68.39 -63.95 0.96 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.528 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.0 m -41.97 -43.48 3.15 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.1 -28.77 69.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -178.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -57.97 -26.24 62.06 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.56 -49.75 76.54 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.72 -0.613 . . . . 0.0 112.054 176.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 133.96 83.79 0.21 Allowed Glycine 0 N--CA 1.468 0.82 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 178.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -14.2 100.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -168.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -89.56 -53.6 4.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.628 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.71 -73.76 0.41 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 -171.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -86.64 73.41 10.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.42 1.105 . . . . 0.0 109.895 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -157.52 -41.59 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.168 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -65.81 -31.75 72.88 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.76 -52.43 56.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.564 -0.71 . . . . 0.0 111.48 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -68.55 -38.36 80.72 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.699 -0.626 . . . . 0.0 112.606 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -55.79 -52.98 62.09 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.8 m -77.86 -33.62 52.08 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -62.06 -28.58 69.71 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -95.87 -35.34 11.51 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 119.102 -1.039 . . . . 0.0 112.538 171.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.9 -78.6 0.1 Allowed 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.205 -0.935 . . . . 0.0 110.126 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.587 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 33.9 t . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 117.338 2.347 . . . . 0.0 117.338 -173.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -97.0 131.4 43.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.825 0.822 . . . . 0.0 110.065 -170.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 23' ' ' SER . 28.8 p -85.82 100.17 11.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.843 -172.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -98.63 85.78 3.42 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 172.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.96 -148.21 0.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.81 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.8 mt -116.67 100.96 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 169.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 140.99 -54.13 0.64 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.217 -0.992 . . . . 0.0 110.686 -173.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.593 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.0 t -77.76 161.52 71.28 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.297 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.593 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 52.1 Cg_exo -71.16 -174.67 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 CA-C-N 120.816 1.327 . . . . 0.0 114.352 -169.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -73.44 146.77 44.76 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.512 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -18.97 64.59 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -175.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -72.61 -31.17 64.97 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.47 -0.769 . . . . 0.0 112.357 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.0 p -73.75 149.28 41.88 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.739 0.781 . . . . 0.0 111.29 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -67.52 -24.26 65.54 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.28 -43.72 98.18 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.55 -0.718 . . . . 0.0 112.717 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -73.79 -29.4 62.15 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.944 -0.702 . . . . 0.0 112.301 177.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.8 -43.47 98.73 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.353 -0.842 . . . . 0.0 112.591 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.42 -42.68 82.82 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.577 HG21 ' SG ' ' A' ' 11' ' ' CYS . 30.1 m -68.76 -25.3 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.509 ' HB2' ' SG ' ' A' ' 6' ' ' CYS . 10.4 t -85.59 -26.91 25.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 118.848 -1.141 . . . . 0.0 113.19 168.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -50.42 -44.07 55.13 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.393 0.997 . . . . 0.0 113.257 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.02 -62.0 1.74 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.752 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.4 m -44.43 -34.39 2.02 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -85.35 -39.43 17.65 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 172.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -66.15 -57.97 6.46 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.997 -1.065 . . . . 0.0 110.761 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -108.6 88.44 2.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.04 -60.19 0.28 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 119.24 -1.457 . . . . 0.0 112.764 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -15.26 111.15 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -168.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -154.33 -51.89 0.09 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.146 -0.621 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.26 -72.21 0.25 Allowed Glycine 0 N--CA 1.466 0.683 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -174.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -67.74 -50.14 58.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.781 173.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -18.91 -57.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -53.03 -54.41 35.71 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -172.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -38.89 -61.49 0.73 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -72.89 -36.96 67.44 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -54.1 -51.43 64.22 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.0 m -77.19 -52.59 8.98 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.409 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -54.7 -37.26 65.62 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -69.54 -56.73 6.53 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.526 -0.734 . . . . 0.0 110.982 175.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.57 56.22 3.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.761 -0.587 . . . . 0.0 111.649 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.472 0.653 0 O-C-N 121.49 -0.756 . . . . 0.0 109.761 179.148 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 tt . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -94.29 142.13 27.76 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.861 0.838 . . . . 0.0 109.01 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 11.9 t -76.63 135.1 39.15 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.934 -171.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -89.36 83.28 6.41 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.22 143.26 33.19 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.697 0.761 . . . . 0.0 110.013 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.5 pt -73.85 -24.73 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.49 60.49 0.54 Allowed Glycine 0 N--CA 1.469 0.86 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.926 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.718 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 15.1 t -116.93 156.0 48.63 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 169.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.718 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 85.0 Cg_exo -59.9 -179.71 0.23 Allowed 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.801 1.667 . . . . 0.0 115.535 -174.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -62.58 163.78 8.5 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.79 0.805 . . . . 0.0 112.612 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.5 tp -57.68 -50.72 72.25 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -171.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -94.35 50.29 1.36 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.999 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.9 p -112.85 169.53 8.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.833 0.825 . . . . 0.0 110.296 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.03 -40.97 78.29 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.135 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.5 -44.05 75.56 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -64.52 -33.08 75.06 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.52 -41.21 89.17 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.507 -0.745 . . . . 0.0 112.159 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.26 -62.21 1.5 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.58 -0.7 . . . . 0.0 111.317 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.1 p -42.19 -46.21 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -174.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -71.25 -40.4 71.02 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -63.25 -38.04 89.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.79 -63.92 0.96 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.421 -0.799 . . . . 0.0 109.769 176.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -44.3 -40.07 4.99 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -56.89 -46.72 81.71 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -67.57 -57.92 5.61 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.772 -0.58 . . . . 0.0 111.143 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -96.5 82.27 3.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 141.55 40.23 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 120.22 -0.991 . . . . 0.0 112.934 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -87.45 81.79 7.71 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.998 -0.707 . . . . 0.0 109.163 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -138.24 -58.62 0.64 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.722 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.04 -68.86 0.5 Allowed Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -172.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -89.8 78.6 6.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 122.455 1.121 . . . . 0.0 108.867 175.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -161.14 -56.98 0.05 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.466 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 90.8 m-85 -38.78 -40.43 0.62 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -174.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -57.96 -47.56 82.57 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -67.78 -41.32 83.44 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.65 -0.656 . . . . 0.0 112.116 176.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -59.39 -45.64 90.9 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 22.6 m -77.22 -40.72 44.02 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -175.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -68.2 -29.82 68.77 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -68.97 -48.7 62.52 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.392 -0.817 . . . . 0.0 111.84 178.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.62 -57.16 3.45 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.805 -0.559 . . . . 0.0 110.967 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 42.6 t . . . . . 0 N--CA 1.468 0.437 0 CA-C-O 122.016 0.912 . . . . 0.0 111.34 -176.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -131.19 165.4 23.42 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.39 137.47 56.9 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.32 -0.862 . . . . 0.0 111.665 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -131.71 76.92 1.74 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 171.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -94.64 -176.49 3.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.922 0.868 . . . . 0.0 111.048 -176.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.9 mm -71.39 -56.68 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.765 -0.585 . . . . 0.0 111.113 -175.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.59 33.94 5.83 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 120.021 -1.085 . . . . 0.0 113.997 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.9 t -116.87 160.4 36.95 Favored Pre-proline 0 CA--C 1.543 0.682 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.1 Cg_exo -67.61 -178.32 1.51 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 CA-C-N 121.082 1.422 . . . . 0.0 114.099 -171.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.3 t -66.23 158.39 29.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.725 0.774 . . . . 0.0 111.594 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.57 -55.23 37.51 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.346 -173.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.41 80.44 8.13 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.927 0.87 . . . . 0.0 110.24 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.9 p -153.81 153.85 32.89 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.549 0.69 . . . . 0.0 109.396 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.42 -36.47 84.27 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -48.5 73.26 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.667 -0.645 . . . . 0.0 112.256 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -63.17 -37.23 86.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.721 -0.612 . . . . 0.0 112.605 175.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.17 -44.17 95.25 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.895 -0.503 . . . . 0.0 111.727 178.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.96 -39.15 93.82 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.653 0.982 . . . . 0.0 113.653 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.0 t -59.6 -49.56 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 O-C-N 121.64 -0.662 . . . . 0.0 111.196 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 95.0 p -66.0 -30.4 70.94 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -61.85 -28.41 69.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -88.25 -55.35 3.78 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 118.769 -1.172 . . . . 0.0 112.896 169.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.7 m -77.99 -47.07 19.36 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -171.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -57.71 -29.37 64.65 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.59 -28.01 65.18 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -77.55 93.27 4.15 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.488 -0.757 . . . . 0.0 110.05 177.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.59 -133.37 11.63 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 119.959 -1.115 . . . . 0.0 111.065 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -164.75 -56.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.094 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -78.28 152.72 32.34 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 122.013 0.911 . . . . 0.0 111.523 -171.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.1 71.9 2.31 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.188 -1.006 . . . . 0.0 113.063 -175.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -141.43 55.86 1.52 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 122.256 1.027 . . . . 0.0 108.424 170.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -174.16 -41.77 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.333 -174.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -68.35 -22.56 64.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -31.31 -51.25 0.18 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -173.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -61.49 -63.53 1.24 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.582 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 14.5 t -38.73 -49.9 1.62 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 17.0 t -68.81 -27.46 65.88 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -87.13 -61.66 1.67 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.019 166.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -28.52 -63.73 0.1 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -88.0 -50.94 6.09 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.465 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.485 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 51.4 t . . . . . 0 N--CA 1.467 0.389 0 CA-C-O 122.146 0.974 . . . . 0.0 110.841 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -127.92 102.17 22.33 Favored Pre-proline 0 N--CA 1.47 0.555 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -60.32 127.4 22.85 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 121.944 1.763 . . . . 0.0 113.2 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.3 tp -93.83 103.35 15.48 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.643 0.735 . . . . 0.0 109.791 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -126.47 165.7 18.62 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 122.211 1.005 . . . . 0.0 109.736 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.4 t -78.89 145.73 33.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.139 0.971 . . . . 0.0 112.891 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -141.01 75.87 1.52 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 169.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.42 -171.82 2.75 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.567 0.699 . . . . 0.0 110.879 -175.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.8 mm -73.32 -64.25 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.586 -0.696 . . . . 0.0 111.01 -173.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -75.54 -58.91 3.7 Favored Glycine 0 N--CA 1.469 0.869 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.471 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -39.44 155.61 0.15 Allowed Pre-proline 0 N--CA 1.476 0.859 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.35 147.15 12.52 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.274 1.982 . . . . 0.0 114.928 -175.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -67.19 162.36 22.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.683 0.754 . . . . 0.0 111.476 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.9 tp -55.24 -46.48 76.01 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -169.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -102.02 42.38 1.14 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.534 -175.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.7 p -106.8 158.56 16.9 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.386 -0.821 . . . . 0.0 110.124 175.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -63.64 -39.91 95.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.435 -179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.47 69.95 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -64.0 -39.57 94.41 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -57.2 -39.2 74.91 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.505 -0.747 . . . . 0.0 112.544 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.26 -50.53 60.12 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.58 -0.7 . . . . 0.0 112.633 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -73.18 -39.24 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.6 p -71.42 -31.86 67.72 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -66.12 -32.43 73.88 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.538 -0.726 . . . . 0.0 112.574 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -63.08 -45.73 90.72 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.596 -0.69 . . . . 0.0 111.776 174.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.9 m -69.93 -35.53 74.6 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -62.75 -40.43 97.24 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.578 -0.701 . . . . 0.0 112.261 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.36 -37.99 89.46 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -76.13 126.31 30.76 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.958 0.885 . . . . 0.0 110.521 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.24 -134.93 17.7 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 120.064 -1.065 . . . . 0.0 111.738 179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -165.49 -67.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -154.27 105.42 2.69 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.99 -114.51 0.45 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.146 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.4 -55.01 4.09 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.757 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -18.67 -67.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.772 2.138 . . . . 0.0 116.772 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -38.69 -40.67 0.63 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 -170.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -72.56 -51.27 20.56 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.236 -0.915 . . . . 0.0 111.951 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -72.03 -25.6 61.87 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.5 t -84.75 -24.16 28.93 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 171.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.6 t -85.92 -23.74 26.86 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 170.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -84.93 -33.62 22.66 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 118.726 -1.19 . . . . 0.0 112.384 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.45 -50.88 19.38 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.967 -1.083 . . . . 0.0 111.143 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -98.7 92.41 5.57 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 167.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t -102.12 -64.27 1.08 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.926 -173.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.3 -89.65 0.08 OUTLIER Glycine 0 CA--C 1.524 0.642 0 C-N-CA 119.838 -1.172 . . . . 0.0 110.434 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.0 t -88.91 105.5 17.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.448 0.642 . . . . 0.0 109.699 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.4 t -88.1 140.88 29.04 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.741 0.781 . . . . 0.0 110.437 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.5 t -86.01 137.72 35.25 Favored Pre-proline 0 N--CA 1.47 0.542 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.084 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.57 112.72 3.21 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 121.718 1.612 . . . . 0.0 110.906 -177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.41 121.16 4.16 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 70.0 m -90.46 109.78 20.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.426 0.631 . . . . 0.0 109.721 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.176 -179.88 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -132.09 93.6 26.17 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -177.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.412 ' O ' ' C ' ' A' ' 4' ' ' LEU . 93.5 Cg_endo -79.78 -105.18 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 121.602 1.535 . . . . 0.0 109.943 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.412 ' C ' ' O ' ' A' ' 3' ' ' PRO . 6.4 tt -16.63 106.46 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -169.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -90.13 142.39 27.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.106 0.955 . . . . 0.0 111.148 -170.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.506 ' H ' ' HB3' ' A' ' 23' ' ' SER . 4.3 t -67.45 109.08 3.05 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.414 177.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 -134.39 78.52 1.76 Allowed 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 175.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -81.49 -102.54 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.894 -176.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.587 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -118.61 107.8 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 119.673 -0.811 . . . . 0.0 108.83 169.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.04 -49.61 1.14 Allowed Glycine 0 CA--C 1.529 0.958 0 C-N-CA 120.124 -1.036 . . . . 0.0 113.122 176.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 3.5 m -27.37 145.28 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 116.893 2.182 . . . . 0.0 116.893 -169.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -48.63 163.99 0.24 Allowed 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 122.667 2.245 . . . . 0.0 116.887 -173.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.6 m -57.08 145.49 30.68 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.862 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.412 ' H ' HD12 ' A' ' 14' ' ' LEU . 7.4 mp -53.02 -51.46 61.62 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -175.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -98.04 75.12 2.32 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.845 0.831 . . . . 0.0 110.192 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.7 p -148.27 165.98 29.36 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.583 0.706 . . . . 0.0 109.615 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -65.16 -35.31 80.71 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -46.13 67.43 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.406 -0.809 . . . . 0.0 111.971 177.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.429 ' HA ' HG12 ' A' ' 22' ' ' VAL . 18.0 t-20 -65.13 -29.72 70.59 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -57.63 -47.51 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.686 -0.634 . . . . 0.0 112.286 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.55 -62.57 1.39 Allowed 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.445 -0.785 . . . . 0.0 111.083 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 19' ' ' ASN . 7.9 p -53.37 -28.8 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -174.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.506 ' HB3' ' H ' ' A' ' 6' ' ' CYS . 89.6 p -86.51 -29.84 22.42 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -62.68 -25.99 68.43 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.953 -1.092 . . . . 0.0 113.15 171.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -85.86 -43.82 12.95 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.926 168.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.66 -41.77 95.86 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.974 1.261 . . . . 0.0 112.645 179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 tpt180 -64.73 -26.5 68.39 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -84.42 -31.48 24.62 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.609 168.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -78.93 -166.05 0.84 Allowed 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.348 -0.845 . . . . 0.0 109.09 169.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.98 -126.42 13.66 Favored Glycine 0 N--CA 1.469 0.868 0 C-N-CA 119.877 -1.154 . . . . 0.0 112.371 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -157.92 -81.66 0.06 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.942 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -157.79 -53.89 0.07 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.37 -173.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.78 -109.29 3.03 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 120.203 -0.999 . . . . 0.0 111.651 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -93.18 30.88 1.55 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -86.72 -16.11 37.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.338 -0.852 . . . . 0.0 112.367 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -69.85 -15.03 63.03 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -33.01 -52.78 0.35 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -172.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 48.3 mtm105 -64.18 -61.78 2.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.678 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 21.0 t -40.97 -47.77 3.07 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.472 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 46.6 t -76.26 -36.81 58.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -71.53 -47.39 55.52 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.598 -0.689 . . . . 0.0 111.406 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -71.16 -43.96 66.48 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.794 -0.566 . . . . 0.0 111.977 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -98.72 86.13 3.47 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 168.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 53.9 t -102.5 -57.18 2.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.76 -177.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.01 -55.6 0.53 Allowed Glycine 0 N--CA 1.469 0.833 0 C-N-CA 120.418 -0.896 . . . . 0.0 111.225 -176.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.0 m -137.34 140.27 41.37 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 176.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 69.2 p -135.46 -50.26 0.73 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.614 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 33.2 m -15.1 101.29 0.05 OUTLIER Pre-proline 0 N--CA 1.481 1.079 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -169.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -62.24 126.08 17.79 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 121.839 1.693 . . . . 0.0 113.276 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.0 121.37 4.38 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.8 t -86.63 -60.78 1.9 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.133 -0.627 . . . . 0.0 111.053 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.373 -0.822 . . . . 0.0 111.269 -177.841 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.23 144.22 33.89 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.937 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.74 121.5 5.95 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.874 1.716 . . . . 0.0 111.258 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.0 tp -89.9 113.52 25.15 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -90.64 77.58 6.35 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.392 0.615 . . . . 0.0 109.574 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -28.82 112.73 0.07 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 -171.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -117.99 83.73 2.05 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.893 0.854 . . . . 0.0 109.504 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.87 169.2 18.4 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.746 0.784 . . . . 0.0 111.13 175.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -71.86 105.82 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 122.11 0.957 . . . . 0.0 110.302 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.87 -80.39 0.29 Allowed Glycine 0 N--CA 1.468 0.798 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -173.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -33.41 153.66 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.868 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 -175.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -44.21 141.38 4.88 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.812 2.341 . . . . 0.0 116.592 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.6 t -86.97 177.8 7.13 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.256 -176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.0 tp -54.49 -40.37 68.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -82.06 81.65 7.93 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.463 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.5 p 168.38 138.96 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 166.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -65.33 -20.74 66.53 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -178.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.3 -33.57 73.79 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.326 -0.859 . . . . 0.0 113.039 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -70.96 -40.04 72.2 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.725 173.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.7 mp -59.09 -35.87 74.15 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 177.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.49 -48.72 66.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.624 -0.672 . . . . 0.0 112.684 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.2 p -70.91 -36.59 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 O-C-N 121.671 -0.643 . . . . 0.0 112.715 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.0 p -67.93 -37.99 82.33 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.608 -0.683 . . . . 0.0 112.618 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -59.77 -35.97 75.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -65.45 -45.59 83.18 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.705 -0.622 . . . . 0.0 112.148 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.1 m -72.47 -38.13 68.3 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.659 -0.651 . . . . 0.0 112.582 178.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -65.91 -26.86 67.8 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -50.63 -39.03 49.33 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -71.91 -57.66 4.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.743 170.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.3 74.87 1.25 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 120.171 -1.014 . . . . 0.0 112.079 173.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -102.56 148.14 25.92 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.631 0.729 . . . . 0.0 110.046 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.8 mt -126.75 86.1 2.47 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 174.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 157.78 -83.42 0.14 Allowed Glycine 0 CA--C 1.526 0.763 0 C-N-CA 119.759 -1.21 . . . . 0.0 111.621 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 28.2 t70 -142.92 129.73 20.46 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 32.7 t70 172.87 -56.89 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 169.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -32.93 -49.53 0.24 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -174.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -33.86 -58.05 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -66.52 -60.2 2.95 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.52 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -36.72 -46.31 0.59 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.8 m -73.54 -45.71 51.98 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -67.25 -29.9 69.65 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.09 -50.24 62.3 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.43 -0.794 . . . . 0.0 111.646 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -87.46 72.64 9.67 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.009 0.909 . . . . 0.0 109.028 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.1 t -166.64 -66.27 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.26 -108.5 0.36 Allowed Glycine 0 N--CA 1.466 0.662 0 C-N-CA 119.823 -1.18 . . . . 0.0 110.728 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.6 m -142.07 107.29 4.98 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.3 p -86.92 132.34 33.84 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.014 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.8 t -14.91 102.34 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.032 0 N-CA-C 117.166 2.284 . . . . 0.0 117.166 -169.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -84.8 97.02 0.67 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 121.405 1.403 . . . . 0.0 110.755 -174.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -24.11 -66.42 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 -172.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -16.43 -73.06 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 117.842 2.534 . . . . 0.0 117.842 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.148 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.461 -177.644 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -114.41 104.8 54.41 Favored Pre-proline 0 CA--C 1.538 0.481 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.9 77.44 2.97 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 121.534 1.489 . . . . 0.0 111.452 -173.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.8 tt -97.14 109.07 21.9 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -115.05 77.15 1.04 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.126 -174.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.4 p -26.37 120.79 0.08 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.882 2.179 . . . . 0.0 116.882 -172.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -94.13 79.67 4.04 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.862 0.839 . . . . 0.0 109.494 178.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -87.44 151.44 23.05 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.651 0.739 . . . . 0.0 110.826 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.72 110.32 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.884 0.85 . . . . 0.0 109.063 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.94 -48.36 0.95 Allowed Glycine 0 CA--C 1.528 0.863 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.169 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.606 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 16.2 t -64.87 150.13 95.31 Favored Pre-proline 0 CA--C 1.542 0.641 0 O-C-N 122.213 -0.581 . . . . 0.0 111.65 -175.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.606 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 92.5 Cg_exo -57.99 174.43 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 121.926 1.751 . . . . 0.0 115.696 -174.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -63.12 167.26 5.12 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.986 0.898 . . . . 0.0 112.849 -174.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 74.6 mt -52.96 -53.65 46.56 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -173.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -97.61 90.49 5.03 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.847 0.832 . . . . 0.0 109.063 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -148.38 176.49 10.23 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.942 0.877 . . . . 0.0 109.956 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -68.15 -45.34 73.81 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.465 -0.772 . . . . 0.0 112.413 -178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.61 -62.12 1.51 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.927 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -40.57 -48.72 2.9 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.581 1.696 . . . . 0.0 115.581 -172.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.71 -45.71 77.82 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.48 71.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.707 -0.62 . . . . 0.0 112.649 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.1 m -68.5 -35.47 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -70.04 -33.54 72.1 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.735 -0.603 . . . . 0.0 112.578 176.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -65.13 -38.61 91.2 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.635 -0.666 . . . . 0.0 112.241 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.99 -44.69 97.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.921 -0.487 . . . . 0.0 112.161 174.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.0 m -72.67 -32.9 66.17 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.2 tpt85 -69.51 -37.54 77.21 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.68 -32.83 74.44 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -142.87 81.99 1.75 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.93 0.871 . . . . 0.0 109.028 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.28 36.16 0.02 OUTLIER Glycine 0 CA--C 1.529 0.96 0 C-N-CA 119.854 -1.165 . . . . 0.0 113.138 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -83.55 94.52 8.08 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.83 0.824 . . . . 0.0 109.906 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.09 -44.28 0.57 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.866 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.6 44.92 1.48 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.45 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -170.74 -46.59 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.56 -29.81 70.85 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -59.63 -33.34 71.38 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -65.44 -54.77 23.66 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.593 -0.692 . . . . 0.0 111.419 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -71.12 -32.73 69.37 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.5 t -67.05 -44.73 79.4 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -176.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 m -66.18 -37.57 85.93 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -53.32 -52.38 59.34 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.843 0.747 . . . . 0.0 112.263 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -29.69 -54.7 0.16 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -99.51 -34.87 10.08 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.465 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.9 t -62.21 -51.12 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.354 -0.841 . . . . 0.0 113.227 -175.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.12 -105.42 2.57 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.994 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.3 t -151.19 -73.98 0.15 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.552 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.4 p -140.37 132.72 28.35 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.7 t -143.81 138.9 15.58 Favored Pre-proline 0 N--CA 1.471 0.58 0 C-N-CA 120.179 -0.609 . . . . 0.0 109.366 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.39 134.22 12.45 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 121.726 1.617 . . . . 0.0 111.278 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.9 111.75 19.07 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 120.092 -0.643 . . . . 0.0 110.327 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.8 p -88.39 -60.21 2.03 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.149 -0.62 . . . . 0.0 111.057 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.605 -0.712 . . . . 0.0 110.199 179.084 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -124.32 96.69 41.26 Favored Pre-proline 0 N--CA 1.47 0.568 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 97.7 Cg_endo -84.0 168.2 12.25 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.557 1.505 . . . . 0.0 112.032 -175.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 3' ' ' PRO . 60.5 tp 170.14 97.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 167.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -104.81 156.4 18.04 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.93 0.871 . . . . 0.0 110.355 -174.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.3 t -85.46 131.82 34.32 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.38 0.609 . . . . 0.0 111.145 -176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -133.8 78.01 1.74 Allowed 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.12 -160.12 0.64 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.435 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.27 100.41 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 169.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 150.08 -53.98 0.5 Allowed Glycine 0 CA--C 1.527 0.817 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.796 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.0 t -74.07 167.19 37.9 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 122.456 -0.437 . . . . 0.0 109.988 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.678 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 71.5 Cg_exo -66.12 175.23 4.98 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.402 1.401 . . . . 0.0 114.739 -169.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.0 m -67.98 142.78 55.86 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.46 -178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.71 -40.4 72.37 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -87.8 60.28 5.83 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.762 0.792 . . . . 0.0 110.728 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.9 p -156.53 143.62 18.86 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.08 -23.99 66.84 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -38.31 90.62 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 0.0 112.487 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -67.35 -39.94 85.8 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.747 -0.596 . . . . 0.0 112.025 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.81 -37.74 69.04 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.73 -43.98 87.37 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.472 -0.768 . . . . 0.0 112.693 176.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' SG ' ' A' ' 11' ' ' CYS . 97.4 t -72.89 -47.1 50.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.756 -0.59 . . . . 0.0 111.629 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 90.9 p -67.85 -24.66 65.29 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -83.93 -22.98 31.34 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 171.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -83.44 -32.11 26.24 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 118.335 -1.346 . . . . 0.0 112.117 168.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.0 m -66.34 -41.39 89.65 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 120.968 -1.083 . . . . 0.0 111.789 170.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.8 tpt85 -35.02 -52.53 0.56 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -35.12 -57.87 0.56 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -171.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -90.24 106.11 18.27 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -175.74 92.16 0.09 OUTLIER Glycine 0 N--CA 1.465 0.608 0 C-N-CA 119.181 -1.485 . . . . 0.0 111.57 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -86.28 -61.6 1.71 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.97 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.5 mt -125.02 -62.54 1.22 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.85 80.48 0.08 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -135.99 -53.58 0.75 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.526 -175.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -70.15 -56.46 6.8 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 120.326 -0.549 . . . . 0.0 111.399 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -29.54 -53.97 0.14 Allowed 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 116.117 1.895 . . . . 0.0 116.117 -172.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -39.55 -55.88 1.75 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -172.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.9 -56.77 10.07 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.189 -0.605 . . . . 0.0 111.057 177.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -38.23 -51.62 1.47 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.72 -34.87 52.53 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -175.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -77.57 -28.5 51.77 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -178.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -96.81 -94.36 0.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 119.351 -0.94 . . . . 0.0 108.809 170.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -28.78 -64.21 0.1 Allowed 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -169.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 42.6 t -17.75 -69.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 117.749 2.499 . . . . 0.0 117.749 -176.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.12 142.26 3.4 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.7 m -83.11 98.24 9.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.011 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 55.4 p -14.28 -72.71 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 -169.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.8 m 168.46 94.25 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.917 0 N-CA-C 103.854 -2.647 . . . . 0.0 103.854 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -84.6 99.44 0.74 Allowed 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.344 1.363 . . . . 0.0 110.848 -174.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.13 111.21 19.13 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.487 0.66 . . . . 0.0 110.285 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.5 p -90.61 129.1 36.77 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.584 0.707 . . . . 0.0 110.251 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.635 -0.697 . . . . 0.0 109.345 179.57 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 121.38 0.609 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -88.41 137.16 30.82 Favored Pre-proline 0 N--CA 1.47 0.528 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.292 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -80.98 83.97 2.1 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.679 1.586 . . . . 0.0 111.316 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.6 tp -97.23 96.18 8.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.772 0.796 . . . . 0.0 109.028 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -120.37 106.44 11.85 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -175.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.4 m -12.79 111.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -137.81 76.42 1.58 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 172.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.75 -168.3 1.55 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.763 0.792 . . . . 0.0 111.252 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -74.93 101.5 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.768 0.794 . . . . 0.0 108.971 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.72 40.41 5.31 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.069 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.579 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 19.9 t -117.38 148.73 43.3 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 169.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.613 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 84.2 Cg_exo -55.52 170.93 0.73 Allowed 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.053 1.835 . . . . 0.0 114.732 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.9 t -65.71 161.72 20.09 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.523 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 tp -57.33 -59.21 5.47 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 -174.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -89.62 79.92 6.74 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 122.386 1.089 . . . . 0.0 110.636 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.7 p -151.96 154.77 36.72 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -60.0 -39.59 86.29 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -41.43 89.92 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -66.15 -48.68 69.98 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.64 -33.08 72.27 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.273 -0.892 . . . . 0.0 113.148 -177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -50.31 64.85 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.419 -0.801 . . . . 0.0 112.291 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -74.08 -33.88 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 61.0 m -69.56 -39.82 77.16 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -176.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -65.96 -29.88 70.35 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.57 -47.21 82.46 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.649 -0.657 . . . . 0.0 111.974 176.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -69.41 -59.96 2.65 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.991 174.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -35.21 -49.23 0.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -170.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -58.66 -55.72 31.43 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -170.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -90.04 90.26 8.06 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.174 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 142.67 -35.06 1.75 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.512 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -14.72 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 117.899 2.555 . . . . 0.0 117.899 -169.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.4 mt -143.09 -70.3 0.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.57 -81.01 0.08 OUTLIER Glycine 0 N--CA 1.467 0.722 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -177.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -87.01 83.22 7.54 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -158.15 -29.14 0.08 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.809 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -99.67 52.71 0.93 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.517 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -80.1 -49.54 11.6 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.023 172.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -75.71 -39.32 57.56 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.875 -0.516 . . . . 0.0 112.347 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 38.2 t -61.96 -43.54 98.63 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.532 -0.73 . . . . 0.0 112.914 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.4 m -68.23 -48.44 65.12 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 120.19 -0.604 . . . . 0.0 112.338 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.15 -41.62 73.6 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.05 -24.55 63.27 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -97.72 -96.62 0.21 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 168.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.613 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.8 t -19.92 -70.08 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 -170.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -94.54 87.05 1.07 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 80.4 p -15.5 -72.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.184 2.661 . . . . 0.0 118.184 -169.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.3 m -82.96 131.55 35.18 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.515 0.674 . . . . 0.0 109.76 -178.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 91.7 m -73.18 121.58 85.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.95 -178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.84 166.84 16.89 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.705 1.603 . . . . 0.0 111.599 -178.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.27 103.94 9.54 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.54 0.686 . . . . 0.0 110.181 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -91.94 113.76 26.12 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.373 0.606 . . . . 0.0 109.854 -178.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.39 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 121.502 0.668 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -143.27 91.66 6.92 Favored Pre-proline 0 N--CA 1.469 0.476 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -63.63 123.2 11.64 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 121.727 1.618 . . . . 0.0 113.162 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 tt -82.86 113.04 20.21 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -79.8 120.51 24.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.557 0.694 . . . . 0.0 110.614 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.437 ' O ' ' SG ' ' A' ' 6' ' ' CYS . 30.1 p -81.79 111.68 18.24 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.965 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -92.65 73.1 5.04 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.894 0.854 . . . . 0.0 109.513 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -91.54 167.02 12.53 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.853 0.835 . . . . 0.0 110.494 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.5 tp -68.1 -38.22 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.64 2.67 73.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 120.035 -1.078 . . . . 0.0 114.925 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.558 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.5 t -94.54 155.22 39.81 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 118.649 1.224 . . . . 0.0 110.424 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.558 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 50.4 Cg_exo -67.21 176.47 4.65 Favored 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 121.542 1.494 . . . . 0.0 113.871 -173.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.7 t -72.59 158.47 35.61 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.882 0.849 . . . . 0.0 111.356 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -61.11 -42.55 98.74 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -70.21 -26.85 64.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -175.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -74.51 148.98 40.46 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.866 0.841 . . . . 0.0 111.329 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.03 -19.49 65.7 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -176.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.88 91.3 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.375 -0.828 . . . . 0.0 112.712 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -68.86 -36.91 78.7 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.658 -0.651 . . . . 0.0 112.002 174.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -62.41 -42.25 99.3 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.679 -0.638 . . . . 0.0 112.226 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.33 -46.11 71.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.405 HG11 ' SG ' ' A' ' 44' ' ' CYS . 7.4 p -68.66 -29.56 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.8 p -64.17 -29.85 70.95 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.8 tptp -66.2 -41.88 89.56 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.578 -0.701 . . . . 0.0 111.761 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -64.23 -44.88 90.49 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 112.05 175.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.27 -31.13 72.12 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.6 tpt180 -63.18 -41.4 99.21 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.536 -0.727 . . . . 0.0 112.516 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -64.86 -36.85 85.67 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 121.597 -0.689 . . . . 0.0 112.416 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.3 mt-30 -81.83 126.15 31.53 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.772 0.796 . . . . 0.0 110.444 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.22 -125.76 8.23 Favored Glycine 0 N--CA 1.467 0.74 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.327 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -163.27 -67.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.402 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.5 tp -136.49 -52.43 0.71 Allowed 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.366 -0.533 . . . . 0.0 110.873 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.49 62.42 0.43 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.909 -1.139 . . . . 0.0 111.644 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -156.9 36.13 0.3 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.654 0.74 . . . . 0.0 111.893 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -161.05 -54.36 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -34.5 -42.32 0.14 Allowed 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -62.75 -57.83 9.58 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.583 -0.447 . . . . 0.0 112.02 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -63.04 -48.12 80.09 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.303 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.3 t -37.78 -59.52 0.81 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.36 -29.69 53.48 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.45 -27.28 69.17 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.939 -1.101 . . . . 0.0 113.811 176.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -97.08 -53.51 3.47 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.622 169.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -77.04 -45.38 27.34 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.488 -0.758 . . . . 0.0 112.935 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.545 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 49.0 t -77.59 142.92 38.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.938 0.875 . . . . 0.0 111.163 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.52 94.82 0.1 Allowed Glycine 0 CA--C 1.524 0.65 0 C-N-CA 119.898 -1.144 . . . . 0.0 110.629 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 70.5 m -92.01 88.39 6.55 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.644 0.735 . . . . 0.0 109.9 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 57.8 m -84.53 -55.0 4.36 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.481 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 76.7 p -75.31 154.25 86.1 Favored Pre-proline 0 N--CA 1.471 0.612 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.913 177.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.54 76.16 4.68 Favored 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 121.681 1.587 . . . . 0.0 111.758 -176.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.1 95.84 0.97 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p 169.82 -54.1 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 168.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.149 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.943 -178.868 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -110.86 106.74 57.78 Favored Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.96 102.86 1.14 Allowed 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 121.426 1.417 . . . . 0.0 110.966 -174.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 43.3 tp -91.16 110.54 21.82 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -87.14 179.39 6.66 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.546 1.165 . . . . 0.0 112.025 -169.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.4 t -113.74 122.97 48.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.049 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -142.94 78.02 1.59 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 122.026 0.917 . . . . 0.0 108.56 174.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . . . -87.0 -168.35 2.21 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.596 0.712 . . . . 0.0 110.848 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.9 mt -76.5 97.03 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.82 0.819 . . . . 0.0 109.038 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.57 47.74 3.4 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.734 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.578 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.2 t -117.3 150.68 46.8 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.578 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.2 Cg_exo -60.94 175.11 1.43 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 121.708 1.605 . . . . 0.0 114.305 -177.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 77.7 p -72.39 150.33 43.51 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.665 0.745 . . . . 0.0 110.862 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -69.02 -12.95 62.15 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 179.488 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -77.25 -33.94 55.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.407 -0.808 . . . . 0.0 111.889 174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.2 p -75.84 153.91 36.5 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.022 0.915 . . . . 0.0 111.44 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -67.57 -27.43 66.92 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -47.11 86.96 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.485 -0.759 . . . . 0.0 113.018 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -70.75 -32.53 69.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.6 mt -62.07 -34.54 76.48 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.522 -0.736 . . . . 0.0 112.619 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -35.09 79.98 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.531 -0.731 . . . . 0.0 112.887 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.0 t -65.15 -49.15 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 121.748 -0.595 . . . . 0.0 111.023 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -65.29 -29.8 70.6 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -67.29 -27.92 67.58 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 178.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -86.77 -37.83 17.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 118.827 -1.149 . . . . 0.0 112.496 168.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.1 m -66.63 -61.05 2.18 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.06 -1.025 . . . . 0.0 112.125 -178.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -36.89 -45.72 0.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.8 -29.55 64.97 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -176.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -64.57 -53.99 39.2 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.531 -0.731 . . . . 0.0 111.186 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.57 97.6 1.4 Allowed Glycine 0 N--CA 1.467 0.726 0 C-N-CA 119.966 -1.111 . . . . 0.0 112.094 172.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -145.16 101.02 3.56 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.7 mp -88.73 157.27 18.57 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.908 0.861 . . . . 0.0 110.201 -175.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.71 -74.81 1.31 Allowed Glycine 0 N--CA 1.468 0.806 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -90.02 103.86 16.48 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -65.02 114.76 4.8 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -22.05 81.93 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 -169.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -88.17 -12.2 44.62 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 -170.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.01 -62.23 1.62 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 118.323 -1.351 . . . . 0.0 108.188 167.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.7 t -43.4 -42.01 4.47 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 8' ' ' ALA . 48.8 t -64.63 -51.35 63.11 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -68.98 -58.18 4.46 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.581 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -31.69 -67.92 0.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -176.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -91.51 52.73 2.12 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.277 0.561 . . . . 0.0 111.579 -176.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.457 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.3 t -167.54 -58.94 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.28 -0.888 . . . . 0.0 110.241 179.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.13 83.62 0.11 Allowed Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.462 ' O ' ' HB ' ' A' ' 47' ' ' THR . 28.0 t -92.09 159.97 15.43 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.89 -179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' A' ' 46' ' ' SER . 6.4 t 169.47 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.781 167.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 71.2 m -142.31 105.38 5.56 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -58.49 -53.01 4.46 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 121.974 1.782 . . . . 0.0 114.539 -178.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -19.73 104.61 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -173.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 95.2 p -87.85 -45.78 10.0 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.22 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.171 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.211 -177.821 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -152.25 151.05 26.81 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.761 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.453 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 79.5 Cg_endo -77.43 164.76 28.31 Favored 'Trans proline' 0 CA--C 1.535 0.532 0 C-N-CA 121.78 1.654 . . . . 0.0 111.824 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 3' ' ' PRO . 8.9 tt 170.34 118.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 104.972 -2.232 . . . . 0.0 104.972 167.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -98.4 172.17 7.71 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.512 0.673 . . . . 0.0 109.726 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 4.3 t -115.04 114.61 25.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.161 169.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -100.59 75.63 1.76 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.68 0.752 . . . . 0.0 110.44 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -107.21 153.8 22.16 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.575 0.702 . . . . 0.0 109.509 172.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.2 tp -68.08 -39.95 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -92.63 31.69 6.0 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.499 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.716 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 2.2 t -117.61 152.21 49.38 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.716 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 49.9 Cg_endo -71.19 -175.48 1.52 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.592 1.528 . . . . 0.0 112.882 -174.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -58.83 149.03 27.83 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.767 0.794 . . . . 0.0 112.563 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.5 mt -59.32 -47.02 86.97 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.643 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -85.04 96.06 9.29 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.393 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 p 169.82 162.32 0.06 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 166.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -61.68 -32.85 73.06 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 -172.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.96 -48.13 81.77 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.546 -0.722 . . . . 0.0 112.565 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -67.78 -40.22 83.99 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.654 -0.654 . . . . 0.0 112.442 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.23 -38.97 88.55 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.29 -39.92 94.56 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.1 t -68.97 -45.42 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 O-C-N 121.771 -0.581 . . . . 0.0 111.377 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.3 p -63.02 -41.59 99.59 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -73.75 -30.93 63.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.57 -51.11 46.23 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.742 -0.599 . . . . 0.0 111.734 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.1 t -76.73 -28.62 55.87 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.718 -0.793 . . . . 0.0 113.021 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -58.52 -41.13 84.78 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.621 -0.674 . . . . 0.0 112.271 170.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -63.11 -36.28 83.07 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.74 -0.6 . . . . 0.0 112.523 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -69.87 -54.61 12.67 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.791 -0.568 . . . . 0.0 111.312 176.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 31' ' ' LYS . . . -94.81 -109.36 2.24 Favored Glycine 0 N--CA 1.468 0.807 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' GLY . 57.6 tptt 169.52 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 167.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.5 mt -124.12 127.4 47.74 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.11 -147.91 14.08 Favored Glycine 0 CA--C 1.526 0.753 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.607 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.7 -35.38 65.15 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.229 -0.571 . . . . 0.0 112.513 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -18.37 -56.94 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.534 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 82.1 m-85 -58.86 -25.48 63.33 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -169.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -66.85 -57.58 6.72 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.121 -0.987 . . . . 0.0 111.4 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -68.99 -60.02 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.225 175.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.9 t -48.6 -29.38 4.23 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 117.095 2.257 . . . . 0.0 117.095 -172.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.8 m -87.08 -45.74 10.43 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 119.029 -1.069 . . . . 0.0 112.683 170.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.37 -41.31 51.66 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -178.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.44 -56.3 4.65 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.63 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -91.78 67.82 5.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.392 -0.818 . . . . 0.0 111.649 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 46.1 t -167.01 151.04 6.83 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 122.001 0.905 . . . . 0.0 109.968 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.3 -145.03 6.7 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 119.796 -1.192 . . . . 0.0 110.864 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.7 p -90.95 137.41 32.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.548 0.689 . . . . 0.0 110.302 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.2 m -75.83 -59.34 2.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.376 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 t -86.52 137.07 34.42 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.72 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.65 115.72 3.67 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.615 1.544 . . . . 0.0 111.071 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.47 118.37 23.71 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.324 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.9 p -149.38 133.58 17.31 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.647 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.174 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.512 -179.5 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -136.45 143.04 41.68 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.51 171.45 18.02 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 121.88 1.72 . . . . 0.0 111.717 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.7 tt -77.92 110.49 12.87 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -80.57 94.2 6.23 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.772 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.2 t -25.32 120.33 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 117.09 2.255 . . . . 0.0 117.09 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -88.48 79.35 7.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.921 0.867 . . . . 0.0 109.749 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.11 162.09 13.69 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 122.034 0.921 . . . . 0.0 111.038 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -76.2 -66.85 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.093 -176.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.84 60.56 0.46 Allowed Glycine 0 N--CA 1.469 0.882 0 C-N-CA 120.151 -1.023 . . . . 0.0 111.872 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.656 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 13.9 t -117.46 154.77 50.61 Favored Pre-proline 0 CA--C 1.542 0.641 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.656 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.9 Cg_exo -58.86 -176.16 0.09 OUTLIER 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.969 1.779 . . . . 0.0 115.464 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.2 m -57.77 144.63 37.68 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.658 0.742 . . . . 0.0 111.636 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.9 tt -53.04 -56.5 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.408 -176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -91.36 68.83 5.91 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.301 1.048 . . . . 0.0 110.71 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.6 p -139.59 160.72 39.21 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.521 0.677 . . . . 0.0 109.254 174.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.31 -31.42 71.26 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.25 -54.63 9.02 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.58 -0.7 . . . . 0.0 112.004 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -68.95 -29.86 68.18 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -61.86 -39.46 91.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.414 -0.804 . . . . 0.0 112.216 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.19 -36.0 81.94 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 173.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.4 t -63.01 -48.68 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.821 -0.549 . . . . 0.0 111.132 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.8 m -64.79 -29.06 70.02 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 177.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -61.84 -54.2 45.43 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.7 -0.625 . . . . 0.0 112.112 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -73.5 -63.88 1.1 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.924 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.5 m -38.84 -43.08 0.9 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 116.925 2.194 . . . . 0.0 116.925 -174.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -48.1 -29.01 3.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -57.16 -31.89 65.85 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -177.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -132.88 121.38 22.8 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.603 -0.686 . . . . 0.0 109.591 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.24 22.09 2.18 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 120.626 -0.797 . . . . 0.0 114.612 175.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -17.72 -72.35 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -172.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.12 165.34 28.56 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.865 0.84 . . . . 0.0 110.62 -178.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.44 -80.04 1.29 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 120.182 -1.009 . . . . 0.0 110.674 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.11 86.63 4.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.306 -1.739 . . . . 0.0 106.306 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.81 118.3 10.13 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -29.17 84.37 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 178.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -94.76 -15.05 24.14 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.681 -1.145 . . . . 0.0 114.073 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -87.23 -33.4 19.32 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 118.833 -1.147 . . . . 0.0 112.465 169.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.7 t -58.82 -47.25 85.45 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.377 -0.827 . . . . 0.0 112.606 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 10.8 m -77.45 -43.6 31.84 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -177.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -68.12 -39.77 82.66 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.586 -0.696 . . . . 0.0 112.774 -177.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -71.77 -45.83 60.34 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.662 -0.649 . . . . 0.0 112.352 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -79.47 -77.51 0.18 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.434 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.527 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 49.4 t -19.39 -70.31 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -170.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.27 94.46 1.98 Allowed Glycine 0 CA--C 1.526 0.765 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.668 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.6 m -76.98 106.34 8.6 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.585 0.707 . . . . 0.0 110.321 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 78.5 m -92.12 -59.45 2.1 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.336 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -146.17 142.85 18.11 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -55.87 125.97 20.85 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.062 1.841 . . . . 0.0 113.789 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -81.3 112.4 18.57 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.489 0.661 . . . . 0.0 110.193 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.1 p -152.68 133.69 14.13 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.203 -0.599 . . . . 0.0 109.583 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.527 -179.178 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 121.476 0.655 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -86.73 145.86 39.97 Favored Pre-proline 0 N--CA 1.471 0.599 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.295 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.09 70.59 5.97 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.573 1.515 . . . . 0.0 112.591 -172.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.2 tp -96.62 104.82 16.84 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -78.66 156.64 28.91 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.07 0.938 . . . . 0.0 110.804 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.442 ' SG ' HG12 ' A' ' 22' ' ' VAL . 4.7 m -67.79 139.64 56.62 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.018 0.913 . . . . 0.0 111.77 178.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -149.4 77.97 1.36 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 173.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.14 -179.35 5.06 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.8 0.81 . . . . 0.0 110.908 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.2 tt -65.06 -38.05 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -129.38 46.96 1.04 Allowed Glycine 0 CA--C 1.529 0.946 0 C-N-CA 120.239 -0.981 . . . . 0.0 112.003 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.536 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 48.5 t -117.27 145.55 36.22 Favored Pre-proline 0 N--CA 1.47 0.529 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 169.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.536 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 91.3 Cg_exo -50.19 150.5 10.56 Favored 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.264 1.976 . . . . 0.0 114.815 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.7 t -78.4 -178.5 5.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.896 0.855 . . . . 0.0 111.859 -173.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.8 -42.67 89.62 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -85.76 70.21 10.67 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.887 0.851 . . . . 0.0 110.216 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -159.6 141.11 12.94 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.7 -34.62 77.53 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.74 -38.54 89.4 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -67.11 -29.13 68.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.95 -38.77 89.74 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.246 -0.909 . . . . 0.0 111.887 174.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.77 72.63 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.442 HG12 ' SG ' ' A' ' 6' ' ' CYS . 65.0 t -69.69 -47.08 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.603 -0.686 . . . . 0.0 110.985 175.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.7 t -63.45 -34.07 76.94 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.281 -0.568 . . . . 0.0 112.422 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.92 -36.64 70.43 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.007 -1.058 . . . . 0.0 112.377 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -76.68 -55.42 5.52 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.8 -0.562 . . . . 0.0 111.756 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.2 m -77.82 -52.21 9.27 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -60.41 -26.68 66.88 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -174.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -49.0 -29.92 5.43 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -63.88 -60.24 3.52 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.383 -0.823 . . . . 0.0 111.083 173.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.76 92.18 2.23 Favored Glycine 0 N--CA 1.468 0.81 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.996 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -157.41 125.09 5.33 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.611 ' H ' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -81.77 166.74 19.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.978 0.894 . . . . 0.0 112.28 -175.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.77 -113.47 4.73 Favored Glycine 0 N--CA 1.466 0.699 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -142.57 47.6 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.71 0.766 . . . . 0.0 110.707 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -93.19 4.7 53.54 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -99.98 -8.44 23.9 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 119.349 -0.941 . . . . 0.0 113.165 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -35.97 -55.06 0.76 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -71.73 -38.33 70.48 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -63.61 -38.87 92.76 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.589 -0.694 . . . . 0.0 112.796 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 84.8 m -64.48 -47.42 79.02 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.37 -30.55 66.28 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.44 -62.04 1.7 Allowed 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.468 -0.77 . . . . 0.0 110.344 177.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 44' ' ' CYS . 40.6 mt-30 -85.58 97.27 9.98 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.506 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 35.2 t 171.91 148.37 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 169.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.57 146.1 33.73 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 120.161 -1.018 . . . . 0.0 111.863 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.3 p -140.17 -64.23 0.48 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.848 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.5 m -76.69 123.61 26.41 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 177.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.2 m -14.25 97.1 0.04 OUTLIER Pre-proline 0 N--CA 1.481 1.12 0 N-CA-C 116.525 2.046 . . . . 0.0 116.525 -168.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -84.73 105.07 0.97 Allowed 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 121.498 1.465 . . . . 0.0 110.824 -174.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.43 110.82 18.49 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.045 -0.662 . . . . 0.0 110.278 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 t -92.01 105.28 17.56 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.629 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.171 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.548 -178.908 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -123.28 100.25 39.28 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.3 85.51 1.19 Allowed 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 121.549 1.499 . . . . 0.0 111.068 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.9 tp -147.88 72.56 1.23 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.276 1.036 . . . . 0.0 108.809 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.577 ' HB3' HD21 ' A' ' 19' ' ' ASN . 76.1 m-85 -105.21 95.09 5.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.257 -174.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -8.71 89.64 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -175.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -125.59 76.45 1.57 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.861 -172.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.94 -172.99 2.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.774 169.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.92 102.67 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 122.192 0.996 . . . . 0.0 109.85 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 138.39 -82.98 0.25 Allowed Glycine 0 N--CA 1.467 0.748 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.89 145.21 0.07 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -174.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.552 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 74.8 Cg_exo -58.18 162.96 10.7 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 121.927 1.751 . . . . 0.0 114.784 -174.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.5 t -67.02 165.52 15.53 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.636 0.731 . . . . 0.0 111.526 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.3 tt -58.08 -54.64 44.7 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.867 -0.52 . . . . 0.0 112.323 -174.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -87.83 79.47 8.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.911 0.862 . . . . 0.0 110.409 -178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.1 p -153.28 149.88 28.37 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.38 -40.2 89.98 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.71 -34.48 77.95 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.577 HD21 ' HB3' ' A' ' 5' ' ' TYR . 26.0 t30 -64.28 -33.64 76.29 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.9 -41.72 96.64 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 111.908 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.93 92.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 175.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.436 HG21 ' SG ' ' A' ' 44' ' ' CYS . 67.5 t -66.41 -52.24 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 O-C-N 121.753 -0.592 . . . . 0.0 111.431 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.8 t -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -55.21 -42.12 72.92 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.148 -0.97 . . . . 0.0 112.528 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -76.19 -54.06 7.36 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.807 -0.558 . . . . 0.0 112.137 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.9 m -77.87 -38.42 45.98 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -173.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.4 ttp85 -67.93 -27.92 67.04 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -86.69 -61.16 1.8 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 118.884 -1.127 . . . . 0.0 111.443 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -92.2 118.79 31.2 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 0.0 109.937 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.14 36.8 5.6 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.359 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -92.91 70.69 4.68 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.757 -0.849 . . . . 0.0 109.311 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.8 mt -138.39 44.7 2.1 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.284 -0.566 . . . . 0.0 111.134 -176.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 80.44 -84.49 1.37 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 120.146 -1.026 . . . . 0.0 112.838 174.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.65 87.96 7.32 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 122.202 1.001 . . . . 0.0 109.867 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -166.32 -38.09 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.04 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.536 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 97.6 m-85 -72.52 -26.83 61.91 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -65.64 -49.55 68.28 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.167 -0.958 . . . . 0.0 111.356 177.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -68.19 -32.44 72.68 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.7 t -69.45 -47.1 65.1 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.386 -0.821 . . . . 0.0 112.585 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.536 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 5.6 m -71.69 -41.09 69.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.425 -0.797 . . . . 0.0 112.254 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -78.91 -29.5 44.25 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -99.04 -60.49 1.52 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.291 175.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -69.97 -71.04 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.498 -172.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.552 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 50.3 t -18.86 -72.1 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 -172.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.46 83.53 0.46 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -87.11 121.66 29.87 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.535 0.683 . . . . 0.0 110.1 -177.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 69.1 p -71.86 -47.1 55.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.9 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 87.9 m -137.03 94.15 12.83 Favored Pre-proline 0 N--CA 1.469 0.503 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -81.73 105.59 1.56 Allowed 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.565 1.51 . . . . 0.0 110.921 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.33 117.35 22.94 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.325 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.6 p -148.07 -62.65 0.26 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.289 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.171 179.494 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -91.69 133.35 31.08 Favored Pre-proline 0 N--CA 1.47 0.555 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -82.38 85.84 1.59 Allowed 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 121.579 1.519 . . . . 0.0 111.491 -174.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 tt -96.3 106.39 18.6 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -135.52 109.09 7.94 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.9 m -13.06 118.12 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -146.39 83.73 1.62 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 170.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.28 -153.76 0.16 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.519 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.7 mm -71.83 -58.88 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.275 -0.89 . . . . 0.0 110.782 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -76.86 -55.9 4.31 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 120.027 -1.082 . . . . 0.0 111.836 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.605 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 6.1 t -30.68 139.28 0.16 Allowed Pre-proline 0 N--CA 1.477 0.881 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -170.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.618 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 39.6 Cg_endo -67.43 176.95 4.31 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 121.738 1.625 . . . . 0.0 113.431 -173.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.3 p -74.12 153.29 39.64 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.656 0.741 . . . . 0.0 111.265 -175.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.763 HD13 ' H ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -71.14 -3.64 21.06 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 -177.214 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -97.31 -19.08 18.77 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.446 -0.784 . . . . 0.0 112.915 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -75.84 146.69 39.67 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.205 -0.934 . . . . 0.0 110.932 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.02 -41.46 71.38 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -172.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.01 76.91 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -71.25 -35.33 71.37 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.75 -30.44 70.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.246 -0.909 . . . . 0.0 112.893 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.27 -53.09 33.1 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.26 -0.9 . . . . 0.0 112.051 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.0 p -67.64 -39.67 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.6 p -75.88 -35.55 59.83 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -176.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -66.48 -29.79 69.98 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.81 -52.29 66.08 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.469 -0.769 . . . . 0.0 112.223 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 66.9 m -76.94 -31.75 56.84 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 178.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 tpt85 -66.36 -43.67 85.35 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.994 -1.066 . . . . 0.0 112.257 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -67.62 -43.88 79.36 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.66 -0.65 . . . . 0.0 112.149 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -120.95 100.15 6.91 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 176.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.27 -53.97 0.31 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 119.89 -1.148 . . . . 0.0 111.309 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -15.04 100.17 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 116.953 2.205 . . . . 0.0 116.953 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.6 tp -160.86 -62.27 0.06 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.918 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.37 -68.46 0.29 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.127 -1.189 . . . . 0.0 110.127 -174.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' ASP . 19.4 m-20 -85.49 85.12 7.45 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' A' ' 34' ' ' ASP . 38.8 t70 172.86 11.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.2 168.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.481 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 95.9 m-85 -101.3 -29.79 11.86 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.581 -1.324 . . . . 0.0 112.295 169.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -70.23 -50.04 43.93 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.149 -0.969 . . . . 0.0 110.918 178.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.492 ' HE ' ' HA ' ' A' ' 35' ' ' ASP . 38.3 ptt180 -67.68 -39.65 84.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 175.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.4 t -65.46 -43.89 88.91 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.485 -0.76 . . . . 0.0 113.051 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.481 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 73.5 m -63.69 -62.32 1.73 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.853 -179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -42.33 -62.65 0.91 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -174.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -36.95 -62.15 0.51 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -173.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.3 mm-40 -91.74 -12.15 34.76 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.618 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 23.9 t -147.56 128.33 14.33 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.136 -0.977 . . . . 0.0 110.522 -174.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.3 -104.58 3.12 Favored Glycine 0 N--CA 1.466 0.698 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.464 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.4 m -88.15 87.15 7.23 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.72 0.771 . . . . 0.0 109.4 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 66.4 p -77.78 121.51 24.15 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.528 0.68 . . . . 0.0 110.741 -173.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.5 p -95.57 119.92 64.4 Favored Pre-proline 0 N--CA 1.47 0.567 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -58.35 124.58 16.2 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 121.894 1.729 . . . . 0.0 113.619 -178.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.82 131.14 7.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.476 0.655 . . . . 0.0 109.317 179.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.8 p -89.73 94.9 10.01 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.041 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.547 -179.06 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 CA-C-O 121.674 0.75 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -78.59 149.21 74.52 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.559 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -77.66 -35.87 1.38 Allowed 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 121.69 1.594 . . . . 0.0 114.042 -176.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.8 tp -14.22 100.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 117.193 2.294 . . . . 0.0 117.193 -168.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -94.37 161.43 14.24 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.858 0.837 . . . . 0.0 110.215 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 t -82.5 85.29 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -124.8 77.26 1.59 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.014 -0.675 . . . . 0.0 110.199 -171.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.421 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . . . -92.08 -106.16 0.11 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.629 -0.829 . . . . 0.0 109.451 173.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.5 mm -90.41 -69.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -171.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.78 -50.98 4.2 Favored Glycine 0 N--CA 1.47 0.923 0 C-N-CA 120.126 -1.035 . . . . 0.0 113.71 -172.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 7.3 t -20.85 133.87 0.04 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 -170.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.728 ' HD2' ' SG ' ' A' ' 44' ' ' CYS . 71.2 Cg_exo -54.43 170.98 0.46 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.329 2.019 . . . . 0.0 114.941 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.8 t -61.68 164.81 5.67 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 122.123 0.963 . . . . 0.0 112.698 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -171.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -99.61 52.05 0.93 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.781 -174.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.2 p -108.21 166.36 10.8 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.778 0.799 . . . . 0.0 110.178 176.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.32 -44.62 78.71 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.423 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.17 81.18 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -65.46 -29.8 70.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.7 -41.46 90.8 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.407 -0.808 . . . . 0.0 113.124 -178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.03 69.74 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.562 -0.711 . . . . 0.0 112.817 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.484 HG21 ' HB2' ' A' ' 44' ' ' CYS . 14.8 p -70.01 -39.79 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.5 p -66.36 -21.95 66.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -82.48 -23.34 34.76 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 171.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -85.64 -49.73 7.77 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.47 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.7 m -70.94 -28.34 64.41 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -67.44 -26.05 66.21 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.954 -1.091 . . . . 0.0 113.279 171.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -84.08 -44.22 14.29 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 118.852 -1.139 . . . . 0.0 111.117 168.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -85.21 71.76 10.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.222 -0.924 . . . . 0.0 109.189 171.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -132.64 125.1 4.04 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -83.98 -101.48 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.022 -0.671 . . . . 0.0 109.432 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.7 mt -140.4 76.19 1.54 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.77 -44.73 3.39 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 119.923 -1.132 . . . . 0.0 113.843 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -68.18 -69.03 0.35 Allowed 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.985 -0.715 . . . . 0.0 111.914 -174.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -19.47 -67.1 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 116.412 2.004 . . . . 0.0 116.412 -173.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -35.32 -47.37 0.41 Allowed 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -174.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -35.39 -53.65 0.65 Allowed 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -175.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -66.4 -61.21 2.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.444 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.8 t -37.07 -49.13 0.84 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 3.1 m -72.49 -35.63 68.21 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -175.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -72.35 -48.55 41.03 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.294 -0.879 . . . . 0.0 111.323 175.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -81.44 -96.27 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -34.14 -53.2 0.48 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -173.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.728 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 43.5 t -69.67 -60.71 2.15 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.78 -132.38 5.62 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.773 -176.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 81.3 p -156.93 143.46 18.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.576 0.703 . . . . 0.0 109.547 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.6 p -137.86 131.83 31.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.644 0.735 . . . . 0.0 109.068 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.4 t -87.77 138.33 31.44 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.878 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.97 98.47 1.12 Allowed 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 121.635 1.557 . . . . 0.0 110.996 -177.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.63 112.57 2.44 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -15.86 108.1 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 -169.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.593 -0.718 . . . . 0.0 109.28 179.434 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -93.47 124.79 56.28 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.231 -0.587 . . . . 0.0 109.544 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -81.45 -48.21 0.06 OUTLIER 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.582 1.521 . . . . 0.0 112.559 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.5 tp -15.3 107.57 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 117.734 2.494 . . . . 0.0 117.734 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -99.36 139.24 35.31 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.962 175.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.8 t -83.92 93.72 8.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.712 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -97.76 78.51 2.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.833 0.825 . . . . 0.0 109.234 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.13 155.54 32.28 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.636 0.732 . . . . 0.0 110.762 177.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.504 HD13 ' H ' ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.59 110.63 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-O 121.871 0.843 . . . . 0.0 109.9 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.3 -42.39 1.82 Allowed Glycine 0 CA--C 1.53 1.013 0 C-N-CA 120.237 -0.982 . . . . 0.0 112.001 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.2 m -80.74 169.47 19.39 Favored Pre-proline 0 CA--C 1.542 0.645 0 O-C-N 122.096 -0.649 . . . . 0.0 110.71 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -58.63 152.84 53.03 Favored 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 121.877 1.718 . . . . 0.0 115.44 -170.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.3 t -76.68 164.43 25.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.556 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.1 tp -50.29 -50.4 50.56 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -173.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -90.84 36.75 0.91 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 119.737 -0.785 . . . . 0.0 112.834 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.6 p -109.98 151.25 27.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.954 0.883 . . . . 0.0 110.451 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.33 -33.54 75.74 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.64 -55.68 24.75 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.718 -0.613 . . . . 0.0 111.215 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 22' ' ' VAL . 20.5 t-20 -37.92 -40.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -177.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.9 mp -54.13 -38.41 65.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.46 -43.42 66.68 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.288 0.848 . . . . 0.0 113.288 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 19' ' ' ASN . 8.1 p -65.23 -22.75 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 176.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -82.42 -55.19 4.65 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 118.224 -1.39 . . . . 0.0 109.493 167.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -36.14 -54.98 0.79 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -175.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -76.93 -46.42 24.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -177.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.4 m -63.07 -50.24 71.37 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.548 -0.72 . . . . 0.0 112.385 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -55.85 -32.68 63.84 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.8 -29.31 68.14 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 175.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -76.04 95.33 3.59 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.67 0.748 . . . . 0.0 110.043 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.41 -130.61 9.95 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.468 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -163.76 -56.19 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.331 -0.548 . . . . 0.0 109.964 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.2 tp -145.38 111.75 5.74 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.75 -167.08 37.23 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 119.719 -1.229 . . . . 0.0 111.846 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -89.49 15.37 9.43 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.15 -27.93 57.18 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.232 -0.918 . . . . 0.0 112.614 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.451 ' O ' ' SG ' ' A' ' 40' ' ' CYS . 22.6 m-85 -71.6 -24.74 61.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -172.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.34 -49.3 77.51 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.416 -0.803 . . . . 0.0 112.072 -177.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -63.45 -39.2 93.85 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.675 -0.641 . . . . 0.0 112.455 176.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.0 t -61.47 -44.95 96.18 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 4.4 m -73.69 -29.21 62.15 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.824 0.675 . . . . 0.0 112.824 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -59.95 -26.85 66.32 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 172.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -92.39 -98.91 0.13 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 167.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -36.57 112.85 0.2 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 52.7 t -158.79 -63.18 0.08 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.268 -169.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.94 -88.68 0.07 OUTLIER Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 80.6 p -86.19 90.4 8.13 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.806 0.812 . . . . 0.0 109.172 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -144.86 -62.93 0.36 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.9 t -85.08 136.09 38.71 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 120.194 -0.602 . . . . 0.0 109.942 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.51 107.82 2.21 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 121.675 1.583 . . . . 0.0 111.043 -176.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -82.07 -55.94 4.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.723 -178.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.6 m -15.57 109.45 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -169.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.732 179.088 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -123.39 94.11 47.02 Favored Pre-proline 0 N--CA 1.47 0.565 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.401 ' O ' ' C ' ' A' ' 4' ' ' LEU . 79.5 Cg_endo -82.73 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.532 0.388 0 C-N-CA 121.642 1.561 . . . . 0.0 110.437 -177.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 3' ' ' PRO . 44.2 tp -15.76 109.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -169.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -84.18 85.86 7.3 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.809 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.5 p -26.14 121.18 0.07 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.578 2.066 . . . . 0.0 116.578 -175.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -89.36 78.97 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.749 0.785 . . . . 0.0 109.852 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -120.83 154.51 35.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.69 0.757 . . . . 0.0 110.144 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.4 mm -81.03 99.86 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-O 121.667 0.746 . . . . 0.0 109.937 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 156.81 -82.65 0.15 Allowed Glycine 0 N--CA 1.467 0.726 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 4.8 t -35.19 150.75 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.892 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -171.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 87.9 Cg_exo -55.87 -173.29 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.4 2.067 . . . . 0.0 116.541 -174.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.7 m -50.91 146.33 6.17 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.436 -176.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.6 tp -55.8 -51.91 65.83 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -100.08 81.9 2.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.694 0.759 . . . . 0.0 109.282 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.7 p -143.67 171.27 14.42 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.842 0.829 . . . . 0.0 110.341 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -67.58 -43.0 81.65 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.761 -0.587 . . . . 0.0 112.36 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.57 -45.21 80.05 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.733 -0.604 . . . . 0.0 112.462 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -65.7 -31.53 72.59 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 57.3 tp -64.32 -41.7 96.68 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.297 -0.877 . . . . 0.0 112.297 175.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.23 76.46 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.636 -0.665 . . . . 0.0 112.785 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.542 HG11 ' SG ' ' A' ' 11' ' ' CYS . 14.6 p -62.72 -41.43 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.691 -0.631 . . . . 0.0 112.396 178.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 93.9 p -66.43 -29.93 70.18 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -67.06 -28.61 68.34 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -86.71 -63.21 1.35 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 118.293 -1.363 . . . . 0.0 109.76 167.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.433 ' SG ' HG22 ' A' ' 22' ' ' VAL . 73.1 m -37.25 -47.84 0.83 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.378 1.992 . . . . 0.0 116.378 -174.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -51.76 -29.16 17.64 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -57.31 -29.31 63.82 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -71.34 176.19 4.8 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.96 0.886 . . . . 0.0 110.662 175.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.4 120.02 17.78 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 120.392 -0.909 . . . . 0.0 113.298 -174.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 ttmt -84.52 95.69 8.9 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.698 0.761 . . . . 0.0 110.084 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -113.1 -45.27 3.18 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.95 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.36 -89.12 0.08 OUTLIER Glycine 0 CA--C 1.523 0.575 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -101.21 44.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.676 0.751 . . . . 0.0 110.376 172.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -96.39 3.63 52.75 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.606 -0.684 . . . . 0.0 112.54 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -99.68 -1.65 37.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.695 169.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -34.05 -54.3 0.48 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 -176.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -68.29 -57.46 5.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.02 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 23.0 t -40.02 -38.46 0.72 Allowed 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 117.571 2.434 . . . . 0.0 117.571 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 90.3 m -90.18 -24.63 20.97 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 172.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -86.22 -25.71 25.46 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -96.58 -46.89 6.15 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.149 -0.969 . . . . 0.0 112.139 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -99.18 71.03 1.8 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 118.993 -1.083 . . . . 0.0 110.719 170.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.617 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.7 t 169.46 -74.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 166.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.52 79.15 1.44 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.39 -178.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.6 p -148.49 112.53 5.18 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 64.2 p -13.89 106.09 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 94.6 m -143.62 96.68 5.61 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -83.13 103.34 1.15 Allowed 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 121.541 1.494 . . . . 0.0 110.864 -175.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.98 104.44 14.05 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.569 0.7 . . . . 0.0 110.305 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 78.8 p -89.79 -58.24 2.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.209 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.203 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.312 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.475 0.805 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -82.72 155.04 68.44 Favored Pre-proline 0 N--CA 1.471 0.591 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.986 178.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -79.59 82.36 2.52 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 121.657 1.572 . . . . 0.0 110.967 -179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.0 tp -157.0 113.31 2.98 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.584 0.707 . . . . 0.0 109.276 -177.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.15 147.87 26.4 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.3 t -85.22 107.56 17.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.058 -173.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -99.92 80.65 2.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.696 0.76 . . . . 0.0 109.447 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.59 -149.28 0.25 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.603 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.51 111.6 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 169.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.84 38.0 6.65 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 120.414 -0.898 . . . . 0.0 113.337 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.648 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 12.6 t -117.93 153.22 50.96 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.648 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 84.0 Cg_exo -56.49 175.75 0.25 Allowed 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 122.093 1.862 . . . . 0.0 114.852 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 75.3 p -59.93 149.21 32.43 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.592 0.71 . . . . 0.0 111.461 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.84 -47.03 77.98 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -171.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.16 0.1 46.82 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 -177.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.3 p -73.12 161.12 30.99 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.902 -1.124 . . . . 0.0 111.626 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -67.63 -33.16 74.42 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.08 -43.57 86.96 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.591 -0.693 . . . . 0.0 112.53 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -66.96 -36.55 82.45 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.644 -0.66 . . . . 0.0 112.313 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.72 -42.63 99.75 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.67 -0.644 . . . . 0.0 111.701 175.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.32 -43.18 99.41 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -70.79 -37.49 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 121.55 -0.719 . . . . 0.0 112.469 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -64.01 -35.11 79.65 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.531 -0.731 . . . . 0.0 112.096 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -57.36 -40.56 78.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -68.39 -63.95 0.96 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.528 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 69.0 m -41.97 -43.48 3.15 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.1 -28.77 69.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -178.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -57.97 -26.24 62.06 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.56 -49.75 76.54 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.72 -0.613 . . . . 0.0 112.054 176.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 133.96 83.79 0.21 Allowed Glycine 0 N--CA 1.468 0.82 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 178.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -14.2 100.94 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -168.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -89.56 -53.6 4.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.628 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.71 -73.76 0.41 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 -171.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -86.64 73.41 10.05 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.42 1.105 . . . . 0.0 109.895 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -157.52 -41.59 0.07 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.168 -176.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -65.81 -31.75 72.88 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -174.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -64.76 -52.43 56.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.564 -0.71 . . . . 0.0 111.48 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -68.55 -38.36 80.72 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.699 -0.626 . . . . 0.0 112.606 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t -55.79 -52.98 62.09 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.8 m -77.86 -33.62 52.08 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -62.06 -28.58 69.71 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -95.87 -35.34 11.51 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 119.102 -1.039 . . . . 0.0 112.538 171.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.9 -78.6 0.1 Allowed 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.205 -0.935 . . . . 0.0 110.126 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.587 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 33.9 t -18.8 -70.3 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 117.338 2.347 . . . . 0.0 117.338 -173.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -107.27 -84.07 1.64 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.6 p 169.22 69.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 166.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 62.7 m -100.88 139.44 36.56 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 57.7 m -133.81 99.82 13.73 Favored Pre-proline 0 N--CA 1.469 0.523 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.99 110.24 2.05 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.532 1.488 . . . . 0.0 110.916 -174.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.9 120.46 4.2 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 90.6 p -89.91 119.49 30.32 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.056 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.576 -179.051 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.74 141.2 14.19 Favored Pre-proline 0 CA--C 1.539 0.532 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -55.23 111.98 0.91 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.214 1.942 . . . . 0.0 114.283 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 tp -151.51 101.57 2.82 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -97.0 131.4 43.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.825 0.822 . . . . 0.0 110.065 -170.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 23' ' ' SER . 28.8 p -85.82 100.17 11.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.843 -172.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -98.63 85.78 3.42 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 172.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.96 -148.21 0.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.81 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.8 mt -116.67 100.96 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 169.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 140.99 -54.13 0.64 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.217 -0.992 . . . . 0.0 110.686 -173.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.593 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.0 t -77.76 161.52 71.28 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.297 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.593 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 52.1 Cg_exo -71.16 -174.67 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 CA-C-N 120.816 1.327 . . . . 0.0 114.352 -169.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -73.44 146.77 44.76 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.512 177.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -18.97 64.59 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -175.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -72.61 -31.17 64.97 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.47 -0.769 . . . . 0.0 112.357 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 89.0 p -73.75 149.28 41.88 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.739 0.781 . . . . 0.0 111.29 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -67.52 -24.26 65.54 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.28 -43.72 98.18 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.55 -0.718 . . . . 0.0 112.717 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -73.79 -29.4 62.15 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 119.944 -0.702 . . . . 0.0 112.301 177.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.8 -43.47 98.73 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.353 -0.842 . . . . 0.0 112.591 177.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.42 -42.68 82.82 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.577 HG21 ' SG ' ' A' ' 11' ' ' CYS . 30.1 m -68.76 -25.3 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.509 ' HB2' ' SG ' ' A' ' 6' ' ' CYS . 10.4 t -85.59 -26.91 25.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 118.848 -1.141 . . . . 0.0 113.19 168.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -50.42 -44.07 55.13 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.393 0.997 . . . . 0.0 113.257 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.02 -62.0 1.74 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.752 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.4 m -44.43 -34.39 2.02 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -85.35 -39.43 17.65 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 172.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -66.15 -57.97 6.46 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.997 -1.065 . . . . 0.0 110.761 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -108.6 88.44 2.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 162.04 -60.19 0.28 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 119.24 -1.457 . . . . 0.0 112.764 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -15.26 111.15 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 117.107 2.262 . . . . 0.0 117.107 -168.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.5 tp -154.33 -51.89 0.09 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.146 -0.621 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 156.26 -72.21 0.25 Allowed Glycine 0 N--CA 1.466 0.683 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -174.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -67.74 -50.14 58.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.781 173.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -18.91 -57.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -53.03 -54.41 35.71 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -172.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -38.89 -61.49 0.73 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -174.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -72.89 -36.96 67.44 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.3 t -54.1 -51.43 64.22 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 96.0 m -77.19 -52.59 8.98 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 120.019 -0.673 . . . . 0.0 112.409 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -54.7 -37.26 65.62 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -69.54 -56.73 6.53 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.526 -0.734 . . . . 0.0 110.982 175.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.57 56.22 3.24 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.761 -0.587 . . . . 0.0 111.649 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.4 t -166.75 -61.73 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.49 -0.756 . . . . 0.0 109.761 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.23 83.17 0.16 Allowed Glycine 0 N--CA 1.466 0.654 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 178.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 33.6 t -92.1 129.67 38.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.629 0.728 . . . . 0.0 110.949 -173.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 74.1 p -72.71 -38.76 67.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.777 175.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 77.3 m -133.19 96.83 17.03 Favored Pre-proline 0 N--CA 1.469 0.518 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -60.15 150.2 80.68 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.997 1.798 . . . . 0.0 114.084 -175.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.26 -65.5 0.17 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.0 177.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 68.0 m -88.96 144.62 26.05 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.589 0.709 . . . . 0.0 110.234 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.327 179.529 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 111.434 0.161 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -137.68 145.28 48.11 Favored Pre-proline 0 N--CA 1.471 0.623 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -74.74 122.11 7.11 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 121.779 1.653 . . . . 0.0 110.713 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 tt -145.88 105.85 4.01 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -94.29 142.13 27.76 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.861 0.838 . . . . 0.0 109.01 175.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 36' ' ' PHE . 11.9 t -76.63 135.1 39.15 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.042 -0.663 . . . . 0.0 111.934 -171.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -89.36 83.28 6.41 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.22 143.26 33.19 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.697 0.761 . . . . 0.0 110.013 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.5 pt -73.85 -24.73 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.49 60.49 0.54 Allowed Glycine 0 N--CA 1.469 0.86 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.926 178.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.718 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 15.1 t -116.93 156.0 48.63 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 169.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.718 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 85.0 Cg_exo -59.9 -179.71 0.23 Allowed 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.801 1.667 . . . . 0.0 115.535 -174.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.1 t -62.58 163.78 8.5 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.79 0.805 . . . . 0.0 112.612 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.5 tp -57.68 -50.72 72.25 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -171.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -94.35 50.29 1.36 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 119.822 -0.751 . . . . 0.0 111.999 -174.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.9 p -112.85 169.53 8.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.833 0.825 . . . . 0.0 110.296 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.03 -40.97 78.29 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.085 -0.646 . . . . 0.0 112.135 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.5 -44.05 75.56 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -64.52 -33.08 75.06 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.52 -41.21 89.17 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.507 -0.745 . . . . 0.0 112.159 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.26 -62.21 1.5 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.58 -0.7 . . . . 0.0 111.317 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.1 p -42.19 -46.21 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -174.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 m -71.25 -40.4 71.02 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -63.25 -38.04 89.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.79 -63.92 0.96 Allowed 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.421 -0.799 . . . . 0.0 109.769 176.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -44.3 -40.07 4.99 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -56.89 -46.72 81.71 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -67.57 -57.92 5.61 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.772 -0.58 . . . . 0.0 111.143 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -96.5 82.27 3.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 173.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 141.55 40.23 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 120.22 -0.991 . . . . 0.0 112.934 178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -87.45 81.79 7.71 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.998 -0.707 . . . . 0.0 109.163 178.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.2 mt -138.24 -58.62 0.64 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.722 -174.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.04 -68.86 0.5 Allowed Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -172.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -89.8 78.6 6.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 122.455 1.121 . . . . 0.0 108.867 175.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -161.14 -56.98 0.05 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.466 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 90.8 m-85 -38.78 -40.43 0.62 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -174.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -57.96 -47.56 82.57 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.8 tpp180 -67.78 -41.32 83.44 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.65 -0.656 . . . . 0.0 112.116 176.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.8 t -59.39 -45.64 90.9 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 36' ' ' PHE . 22.6 m -77.22 -40.72 44.02 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -175.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -68.2 -29.82 68.77 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -68.97 -48.7 62.52 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.392 -0.817 . . . . 0.0 111.84 178.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.62 -57.16 3.45 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.805 -0.559 . . . . 0.0 110.967 -178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 42.6 t -85.59 148.19 26.04 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 122.016 0.912 . . . . 0.0 111.34 -176.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.42 74.57 1.29 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.738 178.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 38.1 t -92.01 -65.51 1.0 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.575 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.46 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.5 m -14.3 105.1 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 -169.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' A' ' 47' ' ' THR . 8.7 t 169.52 136.99 0.06 OUTLIER Pre-proline 0 N--CA 1.477 0.907 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 166.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -54.81 122.84 12.36 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.017 1.812 . . . . 0.0 113.619 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.96 125.3 5.1 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.8 t -16.33 -72.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -169.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.145 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.163 -176.955 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 121.465 0.65 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -154.4 148.03 18.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.701 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.46 93.38 1.08 Allowed 'Trans proline' 0 CA--C 1.533 0.425 0 C-N-CA 121.784 1.656 . . . . 0.0 111.065 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.0 tp -152.7 116.54 4.82 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -131.19 165.4 23.42 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.39 137.47 56.9 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.32 -0.862 . . . . 0.0 111.665 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -131.71 76.92 1.74 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 107.902 -1.148 . . . . 0.0 107.902 171.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -94.64 -176.49 3.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.922 0.868 . . . . 0.0 111.048 -176.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.9 mm -71.39 -56.68 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.765 -0.585 . . . . 0.0 111.113 -175.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.59 33.94 5.83 Favored Glycine 0 CA--C 1.531 1.089 0 C-N-CA 120.021 -1.085 . . . . 0.0 113.997 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.633 ' SG ' ' HD2' ' A' ' 12' ' ' PRO . 5.9 t -116.87 160.4 36.95 Favored Pre-proline 0 CA--C 1.543 0.682 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.633 ' HD2' ' SG ' ' A' ' 11' ' ' CYS . 54.1 Cg_exo -67.61 -178.32 1.51 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 CA-C-N 121.082 1.422 . . . . 0.0 114.099 -171.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.3 t -66.23 158.39 29.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.725 0.774 . . . . 0.0 111.594 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -57.57 -55.23 37.51 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.346 -173.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -87.41 80.44 8.13 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.927 0.87 . . . . 0.0 110.24 -178.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.9 p -153.81 153.85 32.89 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.549 0.69 . . . . 0.0 109.396 176.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.42 -36.47 84.27 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -48.5 73.26 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.667 -0.645 . . . . 0.0 112.256 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -63.17 -37.23 86.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.721 -0.612 . . . . 0.0 112.605 175.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -60.17 -44.17 95.25 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.895 -0.503 . . . . 0.0 111.727 178.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.96 -39.15 93.82 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.653 0.982 . . . . 0.0 113.653 176.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 91.0 t -59.6 -49.56 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 O-C-N 121.64 -0.662 . . . . 0.0 111.196 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 95.0 p -66.0 -30.4 70.94 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -61.85 -28.41 69.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -88.25 -55.35 3.78 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 118.769 -1.172 . . . . 0.0 112.896 169.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.7 m -77.99 -47.07 19.36 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -171.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -57.71 -29.37 64.65 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -176.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.59 -28.01 65.18 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -77.55 93.27 4.15 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.488 -0.757 . . . . 0.0 110.05 177.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 93.59 -133.37 11.63 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 119.959 -1.115 . . . . 0.0 111.065 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -164.75 -56.81 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.094 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.5 mt -78.28 152.72 32.34 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 122.013 0.911 . . . . 0.0 111.523 -171.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.1 71.9 2.31 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.188 -1.006 . . . . 0.0 113.063 -175.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -141.43 55.86 1.52 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 122.256 1.027 . . . . 0.0 108.424 170.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -174.16 -41.77 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.333 -174.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -68.35 -22.56 64.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -31.31 -51.25 0.18 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -173.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -61.49 -63.53 1.24 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.582 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 14.5 t -38.73 -49.9 1.62 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 17.0 t -68.81 -27.46 65.88 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -87.13 -61.66 1.67 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.019 166.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -28.52 -63.73 0.1 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -176.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -88.0 -50.94 6.09 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.465 -177.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.485 ' SG ' ' HD3' ' A' ' 12' ' ' PRO . 51.4 t -75.01 118.68 18.24 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 122.146 0.974 . . . . 0.0 110.841 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.13 65.45 1.59 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.381 -0.914 . . . . 0.0 111.174 -174.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.5 t -16.04 -78.93 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 -168.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.5 m -13.55 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 -168.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.5 t -160.53 140.94 8.58 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.506 -178.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.05 121.66 6.3 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 121.764 1.643 . . . . 0.0 110.887 179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.7 -54.09 6.46 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.111 -0.636 . . . . 0.0 111.802 -178.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 80.9 p -85.87 135.01 33.87 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.6 0.714 . . . . 0.0 110.5 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.336 . . . . . . . . 0 0 . 1 stop_ save_